1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine

C137H238N84O5S — CID 165024752

IUPAC1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine
SMILESC/N=C(/N=C(N)N)NCCc1ccc[nH]1.C/N=C(/N=C(N)N)NCCc1ccco1.C/N=C(\N)N/C(N)=N/CCc1ccc[nH]1.C/N=C(\N)N/C(N)=N/CCc1ccco1.C/N=C(\N)N=C(N)N(C)CCc1ccc[nH]1.CN(C)C(N)=N/C(N)=N/CCc1ccc[nH]1.Cc1cscc1C/N=C(\N)N=C(N)N(C)C.NC(N)=N/C(N)=N/CCc1ccc[nH]1.NC(N)=N/C(N)=N/CCc1ccco1.[H]/N=C(/N(C)CCc1ccc[nH]1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)CCc1ccc[nH]1.[H]/N=C(/N=C(N)N)N(C)CCc1ccc[nH]1.[H]/N=C(/N=C(N)N)N(C)CCc1ccco1.[H]/N=C(\N)N(C)/C(N)=N/CCc1ccc[nH]1.[H]/N=C(\N)N(C)/C(N)=N/CCc1ccco1
InChIInChI=1S/3C10H18N6.C10H17N5S.5C9H16N6.4C9H15N5O.C8H14N6.C8H13N5O/c1-16(2)10(12)15-9(11)14-7-5-8-4-3-6-13-8;1-13-9(11)15-10(12)16(2)7-5-8-4-3-6-14-8;1-15(10(13)16(2)9(11)12)7-5-8-4-3-6-14-8;1-7-5-16-6-8(7)4-13-9(11)14-10(12)15(2)3;1-12-8(10)15-9(11)14-6-4-7-3-2-5-13-7;2*1-15(9(12)14-8(10)11)6-4-7-3-2-5-13-7;1-15(8(10)11)9(12)14-6-4-7-3-2-5-13-7;1-12-9(15-8(10)11)14-6-4-7-3-2-5-13-7;1-12-8(10)14-9(11)13-5-4-7-3-2-6-15-7;1-14(9(12)13-8(10)11)5-4-7-3-2-6-15-7;1-14(8(10)11)9(12)13-5-4-7-3-2-6-15-7;1-12-9(14-8(10)11)13-5-4-7-3-2-6-15-7;9-7(10)14-8(11)13-5-3-6-2-1-4-12-6;9-7(10)13-8(11)12-4-3-6-2-1-5-14-6/h3-4,6,13H,5,7H2,1-2H3,(H4,11,12,14,15);3-4,6,14H,5,7H2,1-2H3,(H4,11,12,13,15);3-4,6,13-14H,5,7H2,1-2H3,(H3,11,12);5-6H,4H2,1-3H3,(H4,11,12,13,14);2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14,15);2*2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14);2-3,5,13H,4,6H2,1H3,(H3,10,11)(H2,12,14);2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14,15);2-3,6H,4-5H2,1H3,(H5,10,11,12,13,14);2-3,6H,4-5H2,1H3,(H5,10,11,12,13);2-3,6H,4-5H2,1H3,(H3,10,11)(H2,12,13);2-3,6H,4-5H2,1H3,(H5,10,11,12,13,14);1-2,4,12H,3,5H2,(H6,9,10,11,13,14);1-2,5H,3-4H2,(H6,9,10,11,12,13)/b;;13-10-;;;;;;;;;;;;
InChIKeyLRVRSGJFOUDSKS-KQHWRAFBSA-N
MW3174.06 g/mol
LogP-3.78
Rot. Bonds44

About 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine

1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine (PubChem CID 165024752) has the molecular formula C137H238N84O5S and a molecular weight of 3174.06 g/mol. Its IUPAC name is 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine.

Molecular Properties

Compound Name1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine
PubChem CID165024752
Molecular FormulaC137H238N84O5S
Molecular Weight3174.06 g/mol
Exact Mass3172.07
IUPAC Name1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine
SMILESC/N=C(/N=C(N)N)NCCc1ccc[nH]1.C/N=C(/N=C(N)N)NCCc1ccco1.C/N=C(\N)N/C(N)=N/CCc1ccc[nH]1.C/N=C(\N)N/C(N)=N/CCc1ccco1.C/N=C(\N)N=C(N)N(C)CCc1ccc[nH]1.CN(C)C(N)=N/C(N)=N/CCc1ccc[nH]1.Cc1cscc1C/N=C(\N)N=C(N)N(C)C.NC(N)=N/C(N)=N/CCc1ccc[nH]1.NC(N)=N/C(N)=N/CCc1ccco1.[H]/N=C(/N(C)CCc1ccc[nH]1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)CCc1ccc[nH]1.[H]/N=C(/N=C(N)N)N(C)CCc1ccc[nH]1.[H]/N=C(/N=C(N)N)N(C)CCc1ccco1.[H]/N=C(\N)N(C)/C(N)=N/CCc1ccc[nH]1.[H]/N=C(\N)N(C)/C(N)=N/CCc1ccco1
InChIInChI=1S/3C10H18N6.C10H17N5S.5C9H16N6.4C9H15N5O.C8H14N6.C8H13N5O/c1-16(2)10(12)15-9(11)14-7-5-8-4-3-6-13-8;1-13-9(11)15-10(12)16(2)7-5-8-4-3-6-14-8;1-15(10(13)16(2)9(11)12)7-5-8-4-3-6-14-8;1-7-5-16-6-8(7)4-13-9(11)14-10(12)15(2)3;1-12-8(10)15-9(11)14-6-4-7-3-2-5-13-7;2*1-15(9(12)14-8(10)11)6-4-7-3-2-5-13-7;1-15(8(10)11)9(12)14-6-4-7-3-2-5-13-7;1-12-9(15-8(10)11)14-6-4-7-3-2-5-13-7;1-12-8(10)14-9(11)13-5-4-7-3-2-6-15-7;1-14(9(12)13-8(10)11)5-4-7-3-2-6-15-7;1-14(8(10)11)9(12)13-5-4-7-3-2-6-15-7;1-12-9(14-8(10)11)13-5-4-7-3-2-6-15-7;9-7(10)14-8(11)13-5-3-6-2-1-4-12-6;9-7(10)13-8(11)12-4-3-6-2-1-5-14-6/h3-4,6,13H,5,7H2,1-2H3,(H4,11,12,14,15);3-4,6,14H,5,7H2,1-2H3,(H4,11,12,13,15);3-4,6,13-14H,5,7H2,1-2H3,(H3,11,12);5-6H,4H2,1-3H3,(H4,11,12,13,14);2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14,15);2*2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14);2-3,5,13H,4,6H2,1H3,(H3,10,11)(H2,12,14);2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14,15);2-3,6H,4-5H2,1H3,(H5,10,11,12,13,14);2-3,6H,4-5H2,1H3,(H5,10,11,12,13);2-3,6H,4-5H2,1H3,(H3,10,11)(H2,12,13);2-3,6H,4-5H2,1H3,(H5,10,11,12,13,14);1-2,4,12H,3,5H2,(H6,9,10,11,13,14);1-2,5H,3-4H2,(H6,9,10,11,12,13)/b;;13-10-;;;;;;;;;;;;
InChIKeyLRVRSGJFOUDSKS-KQHWRAFBSA-N
XLogP-3.78
TPSA1546.18 Ų
H-Bond Donors51
H-Bond Acceptors26
Rotatable Bonds44
Heavy Atoms227
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003174.06
LogP ≤ 5-3.78
H-Bond Donors ≤ 551
H-Bond Acceptors ≤ 1026

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-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine?
The IUPAC name of 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine (CID 165024752) is 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine.
What is the SMILES notation for 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine?
The canonical SMILES for 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine is C/N=C(/N=C(N)N)NCCc1ccc[nH]1.C/N=C(/N=C(N)N)NCCc1ccco1.C/N=C(\N)N/C(N)=N/CCc1ccc[nH]1.C/N=C(\N)N/C(N)=N/CCc1ccco1.C/N=C(\N)N=C(N)N(C)CCc1ccc[nH]1.CN(C)C(N)=N/C(N)=N/CCc1ccc[nH]1.Cc1cscc1C/N=C(\N)N=C(N)N(C)C.NC(N)=N/C(N)=N/CCc1ccc[nH]1.NC(N)=N/C(N)=N/CCc1ccco1.[H]/N=C(/N(C)CCc1ccc[nH]1)N(C)/C(N)=N/[H].[H]/N=C(/N=C(N)N)N(C)CCc1ccc[nH]1.[H]/N=C(/N=C(N)N)N(C)CCc1ccc[nH]1.[H]/N=C(/N=C(N)N)N(C)CCc1ccco1.[H]/N=C(\N)N(C)/C(N)=N/CCc1ccc[nH]1.[H]/N=C(\N)N(C)/C(N)=N/CCc1ccco1.
What is the InChIKey of 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine?
The InChIKey is LRVRSGJFOUDSKS-KQHWRAFBSA-N. The full InChI is InChI=1S/3C10H18N6.C10H17N5S.5C9H16N6.4C9H15N5O.C8H14N6.C8H13N5O/c1-16(2)10(12)15-9(11)14-7-5-8-4-3-6-13-8;1-13-9(11)15-10(12)16(2)7-5-8-4-3-6-14-8;1-15(10(13)16(2)9(11)12)7-5-8-4-3-6-14-8;1-7-5-16-6-8(7)4-13-9(11)14-10(12)15(2)3;1-12-8(10)15-9(11)14-6-4-7-3-2-5-13-7;2*1-15(9(12)14-8(10)11)6-4-7-3-2-5-13-7;1-15(8(10)11)9(12)14-6-4-7-3-2-5-13-7;1-12-9(15-8(10)11)14-6-4-7-3-2-5-13-7;1-12-8(10)14-9(11)13-5-4-7-3-2-6-15-7;1-14(9(12)13-8(10)11)5-4-7-3-2-6-15-7;1-14(8(10)11)9(12)13-5-4-7-3-2-6-15-7;1-12-9(14-8(10)11)13-5-4-7-3-2-6-15-7;9-7(10)14-8(11)13-5-3-6-2-1-4-12-6;9-7(10)13-8(11)12-4-3-6-2-1-5-14-6/h3-4,6,13H,5,7H2,1-2H3,(H4,11,12,14,15);3-4,6,14H,5,7H2,1-2H3,(H4,11,12,13,15);3-4,6,13-14H,5,7H2,1-2H3,(H3,11,12);5-6H,4H2,1-3H3,(H4,11,12,13,14);2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14,15);2*2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14);2-3,5,13H,4,6H2,1H3,(H3,10,11)(H2,12,14);2-3,5,13H,4,6H2,1H3,(H5,10,11,12,14,15);2-3,6H,4-5H2,1H3,(H5,10,11,12,13,14);2-3,6H,4-5H2,1H3,(H5,10,11,12,13);2-3,6H,4-5H2,1H3,(H3,10,11)(H2,12,13);2-3,6H,4-5H2,1H3,(H5,10,11,12,13,14);1-2,4,12H,3,5H2,(H6,9,10,11,13,14);1-2,5H,3-4H2,(H6,9,10,11,12,13)/b;;13-10-;;;;;;;;;;;;.
What are the key properties of 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine?
1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine has a molecular weight of 3174.06 g/mol, XLogP of -3.78, 44 rotatable bonds, 51 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbamimidoyl-1,3-dimethyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-carbamimidoyl-2-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-carbamimidoyl-1-methyl-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-(diaminomethylidene)-2-[2-(furan-2-yl)ethyl]guanidine;1-(diaminomethylidene)-3-[2-(furan-2-yl)ethyl]-2-methylguanidine;3-(diaminomethylidene)-1-[2-(furan-2-yl)ethyl]-1-methylguanidine;1-(diaminomethylidene)-2-methyl-3-[2-(1H-pyrrol-2-yl)ethyl]guanidine;bis(3-(diaminomethylidene)-1-methyl-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine);1-(diaminomethylidene)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1,1-dimethyl-2-[N'-[(4-methylthiophen-3-yl)methyl]carbamimidoyl]guanidine;1,1-dimethyl-2-[N'-[2-(1H-pyrrol-2-yl)ethyl]carbamimidoyl]guanidine;1-[N'-[2-(furan-2-yl)ethyl]carbamimidoyl]-2-methylguanidine;1-(N'-methylcarbamimidoyl)-2-[2-(1H-pyrrol-2-yl)ethyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-[2-(1H-pyrrol-2-yl)ethyl]guanidine is sourced from PubChem (CID 165024752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).