1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine

C128H214N78O3S9 — CID 158427748

IUPAC1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine
SMILESC/N=C(/N=C(N)N)N(C)Cc1ccsc1.C/N=C(/N=C(N)N)NCc1ccc(C)[nH]1.C/N=C(/N=C(N)N)NCc1ccsc1.C/N=C(\N)N/C(N)=N/Cc1ccsc1.C/N=C(\N)N=C(N)N(C)Cc1ccoc1.C/N=C(\N)N=C(N)N(C)Cc1ccsc1.CN(C)C(N)=N/C(N)=N/Cc1ccoc1.CN(C)C(N)=N/C(N)=N/Cc1ccsc1.Cc1ccc(C/N=C(\N)N=C(N)N)[nH]1.NC(N)=N/C(N)=N/Cc1ccsc1.[H]/N=C(/N(C)Cc1ccoc1)N(C)/C(N)=N/[H].[H]/N=C(/N(C)Cc1ccsc1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)Cc1ccsc1.[H]/N=C(\N)N(C)/C(N)=N/Cc1ccsc1.[H]/N=C(\N=C(N)N)N(C)Cc1ccc(C)[nH]1
InChIInChI=1S/2C9H16N6.3C9H15N5O.4C9H15N5S.C8H14N6.4C8H13N5S.C7H11N5S/c1-6-3-4-7(13-6)5-15(2)9(12)14-8(10)11;1-6-3-4-7(14-6)5-13-9(12-2)15-8(10)11;1-14(2)9(11)13-8(10)12-5-7-3-4-15-6-7;1-12-8(10)13-9(11)14(2)5-7-3-4-15-6-7;1-13(5-7-3-4-15-6-7)9(12)14(2)8(10)11;1-14(2)9(11)13-8(10)12-5-7-3-4-15-6-7;1-12-8(10)13-9(11)14(2)5-7-3-4-15-6-7;1-13(5-7-3-4-15-6-7)9(12)14(2)8(10)11;1-12-9(13-8(10)11)14(2)5-7-3-4-15-6-7;1-5-2-3-6(13-5)4-12-8(11)14-7(9)10;1-11-7(9)13-8(10)12-4-6-2-3-14-5-6;1-13(8(11)12-7(9)10)4-6-2-3-14-5-6;1-13(7(9)10)8(11)12-4-6-2-3-14-5-6;1-11-8(13-7(9)10)12-4-6-2-3-14-5-6;8-6(9)12-7(10)11-3-5-1-2-13-4-5/h3-4,13H,5H2,1-2H3,(H5,10,11,12,14);3-4,14H,5H2,1-2H3,(H5,10,11,12,13,15);2*3-4,6H,5H2,1-2H3,(H4,10,11,12,13);3-4,6,12H,5H2,1-2H3,(H3,10,11);2*3-4,6H,5H2,1-2H3,(H4,10,11,12,13);3-4,6,12H,5H2,1-2H3,(H3,10,11);3-4,6H,5H2,1-2H3,(H4,10,11,12,13);2-3,13H,4H2,1H3,(H6,9,10,11,12,14);2-3,5H,4H2,1H3,(H5,9,10,11,12,13);2-3,5H,4H2,1H3,(H5,9,10,11,12);2-3,5H,4H2,1H3,(H3,9,10)(H2,11,12);2-3,5H,4H2,1H3,(H5,9,10,11,12,13);1-2,4H,3H2,(H6,8,9,10,11,12)/b;;;;12-9-;;;12-9-;;;;;;;
InChIKeyHBGNRCQOULVGCT-OIBBYHEASA-N
MW3182.27 g/mol
LogP2.52
Rot. Bonds30

About 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine

1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine (PubChem CID 158427748) has the molecular formula C128H214N78O3S9 and a molecular weight of 3182.27 g/mol. Its IUPAC name is 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine.

Molecular Properties

Compound Name1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine
PubChem CID158427748
Molecular FormulaC128H214N78O3S9
Molecular Weight3182.27 g/mol
Exact Mass3179.65
IUPAC Name1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine
SMILESC/N=C(/N=C(N)N)N(C)Cc1ccsc1.C/N=C(/N=C(N)N)NCc1ccc(C)[nH]1.C/N=C(/N=C(N)N)NCc1ccsc1.C/N=C(\N)N/C(N)=N/Cc1ccsc1.C/N=C(\N)N=C(N)N(C)Cc1ccoc1.C/N=C(\N)N=C(N)N(C)Cc1ccsc1.CN(C)C(N)=N/C(N)=N/Cc1ccoc1.CN(C)C(N)=N/C(N)=N/Cc1ccsc1.Cc1ccc(C/N=C(\N)N=C(N)N)[nH]1.NC(N)=N/C(N)=N/Cc1ccsc1.[H]/N=C(/N(C)Cc1ccoc1)N(C)/C(N)=N/[H].[H]/N=C(/N(C)Cc1ccsc1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)Cc1ccsc1.[H]/N=C(\N)N(C)/C(N)=N/Cc1ccsc1.[H]/N=C(\N=C(N)N)N(C)Cc1ccc(C)[nH]1
InChIInChI=1S/2C9H16N6.3C9H15N5O.4C9H15N5S.C8H14N6.4C8H13N5S.C7H11N5S/c1-6-3-4-7(13-6)5-15(2)9(12)14-8(10)11;1-6-3-4-7(14-6)5-13-9(12-2)15-8(10)11;1-14(2)9(11)13-8(10)12-5-7-3-4-15-6-7;1-12-8(10)13-9(11)14(2)5-7-3-4-15-6-7;1-13(5-7-3-4-15-6-7)9(12)14(2)8(10)11;1-14(2)9(11)13-8(10)12-5-7-3-4-15-6-7;1-12-8(10)13-9(11)14(2)5-7-3-4-15-6-7;1-13(5-7-3-4-15-6-7)9(12)14(2)8(10)11;1-12-9(13-8(10)11)14(2)5-7-3-4-15-6-7;1-5-2-3-6(13-5)4-12-8(11)14-7(9)10;1-11-7(9)13-8(10)12-4-6-2-3-14-5-6;1-13(8(11)12-7(9)10)4-6-2-3-14-5-6;1-13(7(9)10)8(11)12-4-6-2-3-14-5-6;1-11-8(13-7(9)10)12-4-6-2-3-14-5-6;8-6(9)12-7(10)11-3-5-1-2-13-4-5/h3-4,13H,5H2,1-2H3,(H5,10,11,12,14);3-4,14H,5H2,1-2H3,(H5,10,11,12,13,15);2*3-4,6H,5H2,1-2H3,(H4,10,11,12,13);3-4,6,12H,5H2,1-2H3,(H3,10,11);2*3-4,6H,5H2,1-2H3,(H4,10,11,12,13);3-4,6,12H,5H2,1-2H3,(H3,10,11);3-4,6H,5H2,1-2H3,(H4,10,11,12,13);2-3,13H,4H2,1H3,(H6,9,10,11,12,14);2-3,5H,4H2,1H3,(H5,9,10,11,12,13);2-3,5H,4H2,1H3,(H5,9,10,11,12);2-3,5H,4H2,1H3,(H3,9,10)(H2,11,12);2-3,5H,4H2,1H3,(H5,9,10,11,12,13);1-2,4H,3H2,(H6,8,9,10,11,12)/b;;;;12-9-;;;12-9-;;;;;;;
InChIKeyHBGNRCQOULVGCT-OIBBYHEASA-N
XLogP2.52
TPSA1393.59 Ų
H-Bond Donors43
H-Bond Acceptors31
Rotatable Bonds30
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003182.27
LogP ≤ 52.52
H-Bond Donors ≤ 543
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine?
The IUPAC name of 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine (CID 158427748) is 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine.
What is the SMILES notation for 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine?
The canonical SMILES for 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine is C/N=C(/N=C(N)N)N(C)Cc1ccsc1.C/N=C(/N=C(N)N)NCc1ccc(C)[nH]1.C/N=C(/N=C(N)N)NCc1ccsc1.C/N=C(\N)N/C(N)=N/Cc1ccsc1.C/N=C(\N)N=C(N)N(C)Cc1ccoc1.C/N=C(\N)N=C(N)N(C)Cc1ccsc1.CN(C)C(N)=N/C(N)=N/Cc1ccoc1.CN(C)C(N)=N/C(N)=N/Cc1ccsc1.Cc1ccc(C/N=C(\N)N=C(N)N)[nH]1.NC(N)=N/C(N)=N/Cc1ccsc1.[H]/N=C(/N(C)Cc1ccoc1)N(C)/C(N)=N/[H].[H]/N=C(/N(C)Cc1ccsc1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)Cc1ccsc1.[H]/N=C(\N)N(C)/C(N)=N/Cc1ccsc1.[H]/N=C(\N=C(N)N)N(C)Cc1ccc(C)[nH]1.
What is the InChIKey of 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine?
The InChIKey is HBGNRCQOULVGCT-OIBBYHEASA-N. The full InChI is InChI=1S/2C9H16N6.3C9H15N5O.4C9H15N5S.C8H14N6.4C8H13N5S.C7H11N5S/c1-6-3-4-7(13-6)5-15(2)9(12)14-8(10)11;1-6-3-4-7(14-6)5-13-9(12-2)15-8(10)11;1-14(2)9(11)13-8(10)12-5-7-3-4-15-6-7;1-12-8(10)13-9(11)14(2)5-7-3-4-15-6-7;1-13(5-7-3-4-15-6-7)9(12)14(2)8(10)11;1-14(2)9(11)13-8(10)12-5-7-3-4-15-6-7;1-12-8(10)13-9(11)14(2)5-7-3-4-15-6-7;1-13(5-7-3-4-15-6-7)9(12)14(2)8(10)11;1-12-9(13-8(10)11)14(2)5-7-3-4-15-6-7;1-5-2-3-6(13-5)4-12-8(11)14-7(9)10;1-11-7(9)13-8(10)12-4-6-2-3-14-5-6;1-13(8(11)12-7(9)10)4-6-2-3-14-5-6;1-13(7(9)10)8(11)12-4-6-2-3-14-5-6;1-11-8(13-7(9)10)12-4-6-2-3-14-5-6;8-6(9)12-7(10)11-3-5-1-2-13-4-5/h3-4,13H,5H2,1-2H3,(H5,10,11,12,14);3-4,14H,5H2,1-2H3,(H5,10,11,12,13,15);2*3-4,6H,5H2,1-2H3,(H4,10,11,12,13);3-4,6,12H,5H2,1-2H3,(H3,10,11);2*3-4,6H,5H2,1-2H3,(H4,10,11,12,13);3-4,6,12H,5H2,1-2H3,(H3,10,11);3-4,6H,5H2,1-2H3,(H4,10,11,12,13);2-3,13H,4H2,1H3,(H6,9,10,11,12,14);2-3,5H,4H2,1H3,(H5,9,10,11,12,13);2-3,5H,4H2,1H3,(H5,9,10,11,12);2-3,5H,4H2,1H3,(H3,9,10)(H2,11,12);2-3,5H,4H2,1H3,(H5,9,10,11,12,13);1-2,4H,3H2,(H6,8,9,10,11,12)/b;;;;12-9-;;;12-9-;;;;;;;.
What are the key properties of 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine?
1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine has a molecular weight of 3182.27 g/mol, XLogP of 2.52, 30 rotatable bonds, 43 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbamimidoyl-1,3-dimethyl-3-(thiophen-3-ylmethyl)guanidine;1-carbamimidoyl-3-(furan-3-ylmethyl)-1,3-dimethylguanidine;1-carbamimidoyl-1-methyl-2-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-methyl-3-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;3-(diaminomethylidene)-1-methyl-1-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-[(5-methyl-1H-pyrrol-2-yl)methyl]guanidine;1-(diaminomethylidene)-2-methyl-3-(thiophen-3-ylmethyl)guanidine;3-(diaminomethylidene)-1-methyl-1-(thiophen-3-ylmethyl)guanidine;1-(diaminomethylidene)-2-(thiophen-3-ylmethyl)guanidine;1,1-dimethyl-2-[N'-(thiophen-3-ylmethyl)carbamimidoyl]guanidine;2-[N'-(furan-3-ylmethyl)carbamimidoyl]-1,1-dimethylguanidine;1-(furan-3-ylmethyl)-1-methyl-2-(N'-methylcarbamimidoyl)guanidine;1-(N'-methylcarbamimidoyl)-2-(thiophen-3-ylmethyl)guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(thiophen-3-ylmethyl)guanidine is sourced from PubChem (CID 158427748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).