1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine

C98H169N69O3 — CID 159716128

IUPAC1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine
SMILESC/N=C(/N=C(N)N)N(C)c1ccc(C)[nH]1.C/N=C(/N=C(N)N)Nc1ccc(C)[nH]1.C/N=C(/N=C(N)N)Nc1ccc(C)o1.C/N=C(\N)N=C(N)N(C)c1ccc(C)[nH]1.C/N=C(\N)N=C(N)Nc1ccc(C)[nH]1.Cc1ccc(N=C(N)N=C(N)N(C)C)[nH]1.Cc1ccc(N=C(N)N=C(N)N)[nH]1.Cc1ccc(N=C(N)N=C(N)N)o1.[H]/N=C(\N(C)/C(N)=N/[H])N(C)c1ccc(C)[nH]1.[H]/N=C(\N)N(C)C(N)=Nc1ccc(C)[nH]1.[H]/N=C(\N=C(N)N)N(C)c1ccc(C)[nH]1.[H]/N=C(\N=C(N)N)N(C)c1ccc(C)o1
InChIInChI=1S/4C9H16N6.4C8H14N6.2C8H13N5O.C7H12N6.C7H11N5O/c1-6-4-5-7(12-6)13-8(10)14-9(11)15(2)3;1-6-4-5-7(13-6)15(3)9(11)14-8(10)12-2;1-6-4-5-7(13-6)14(2)9(12)15(3)8(10)11;1-6-4-5-7(13-6)15(3)9(12-2)14-8(10)11;1-5-3-4-6(12-5)13-8(10)14-7(9)11-2;1-5-3-4-6(12-5)14(2)8(11)13-7(9)10;1-5-3-4-6(12-5)13-8(11)14(2)7(9)10;1-5-3-4-6(12-5)13-8(11-2)14-7(9)10;1-5-3-4-6(14-5)13(2)8(11)12-7(9)10;1-5-3-4-6(14-5)12-8(11-2)13-7(9)10;1-4-2-3-5(11-4)12-7(10)13-6(8)9;1-4-2-3-5(13-4)11-7(10)12-6(8)9/h4-5,12H,1-3H3,(H4,10,11,13,14);4-5,13H,1-3H3,(H4,10,11,12,14);4-5,12-13H,1-3H3,(H3,10,11);4-5,13H,1-3H3,(H4,10,11,12,14);3-4,12H,1-2H3,(H5,9,10,11,13,14);3-4,12H,1-2H3,(H5,9,10,11,13);3-4,12H,1-2H3,(H3,9,10)(H2,11,13);3-4,12H,1-2H3,(H5,9,10,11,13,14);3-4H,1-2H3,(H5,9,10,11,12);3-4H,1-2H3,(H5,9,10,11,12,13);2-3,11H,1H3,(H6,8,9,10,12,13);2-3H,1H3,(H6,8,9,10,11,12)/b;;12-9-;;;;;;;;;
InChIKeyMZLLNVDEOZVJRE-BGZOAVKZSA-N
MW2361.91 g/mol
LogP0.59
Rot. Bonds12

About 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine

1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine (PubChem CID 159716128) has the molecular formula C98H169N69O3 and a molecular weight of 2361.91 g/mol. Its IUPAC name is 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine.

Molecular Properties

Compound Name1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine
PubChem CID159716128
Molecular FormulaC98H169N69O3
Molecular Weight2361.91 g/mol
Exact Mass2360.52
IUPAC Name1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine
SMILESC/N=C(/N=C(N)N)N(C)c1ccc(C)[nH]1.C/N=C(/N=C(N)N)Nc1ccc(C)[nH]1.C/N=C(/N=C(N)N)Nc1ccc(C)o1.C/N=C(\N)N=C(N)N(C)c1ccc(C)[nH]1.C/N=C(\N)N=C(N)Nc1ccc(C)[nH]1.Cc1ccc(N=C(N)N=C(N)N(C)C)[nH]1.Cc1ccc(N=C(N)N=C(N)N)[nH]1.Cc1ccc(N=C(N)N=C(N)N)o1.[H]/N=C(\N(C)/C(N)=N/[H])N(C)c1ccc(C)[nH]1.[H]/N=C(\N)N(C)C(N)=Nc1ccc(C)[nH]1.[H]/N=C(\N=C(N)N)N(C)c1ccc(C)[nH]1.[H]/N=C(\N=C(N)N)N(C)c1ccc(C)o1
InChIInChI=1S/4C9H16N6.4C8H14N6.2C8H13N5O.C7H12N6.C7H11N5O/c1-6-4-5-7(12-6)13-8(10)14-9(11)15(2)3;1-6-4-5-7(13-6)15(3)9(11)14-8(10)12-2;1-6-4-5-7(13-6)14(2)9(12)15(3)8(10)11;1-6-4-5-7(13-6)15(3)9(12-2)14-8(10)11;1-5-3-4-6(12-5)13-8(10)14-7(9)11-2;1-5-3-4-6(12-5)14(2)8(11)13-7(9)10;1-5-3-4-6(12-5)13-8(11)14(2)7(9)10;1-5-3-4-6(12-5)13-8(11-2)14-7(9)10;1-5-3-4-6(14-5)13(2)8(11)12-7(9)10;1-5-3-4-6(14-5)12-8(11-2)13-7(9)10;1-4-2-3-5(11-4)12-7(10)13-6(8)9;1-4-2-3-5(13-4)11-7(10)12-6(8)9/h4-5,12H,1-3H3,(H4,10,11,13,14);4-5,13H,1-3H3,(H4,10,11,12,14);4-5,12-13H,1-3H3,(H3,10,11);4-5,13H,1-3H3,(H4,10,11,12,14);3-4,12H,1-2H3,(H5,9,10,11,13,14);3-4,12H,1-2H3,(H5,9,10,11,13);3-4,12H,1-2H3,(H3,9,10)(H2,11,13);3-4,12H,1-2H3,(H5,9,10,11,13,14);3-4H,1-2H3,(H5,9,10,11,12);3-4H,1-2H3,(H5,9,10,11,12,13);2-3,11H,1H3,(H6,8,9,10,12,13);2-3H,1H3,(H6,8,9,10,11,12)/b;;12-9-;;;;;;;;;
InChIKeyMZLLNVDEOZVJRE-BGZOAVKZSA-N
XLogP0.59
TPSA1248.13 Ų
H-Bond Donors42
H-Bond Acceptors17
Rotatable Bonds12
Heavy Atoms170
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002361.91
LogP ≤ 50.59
H-Bond Donors ≤ 542
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

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

Analyze 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine?
The IUPAC name of 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine (CID 159716128) is 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine.
What is the SMILES notation for 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine?
The canonical SMILES for 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine is C/N=C(/N=C(N)N)N(C)c1ccc(C)[nH]1.C/N=C(/N=C(N)N)Nc1ccc(C)[nH]1.C/N=C(/N=C(N)N)Nc1ccc(C)o1.C/N=C(\N)N=C(N)N(C)c1ccc(C)[nH]1.C/N=C(\N)N=C(N)Nc1ccc(C)[nH]1.Cc1ccc(N=C(N)N=C(N)N(C)C)[nH]1.Cc1ccc(N=C(N)N=C(N)N)[nH]1.Cc1ccc(N=C(N)N=C(N)N)o1.[H]/N=C(\N(C)/C(N)=N/[H])N(C)c1ccc(C)[nH]1.[H]/N=C(\N)N(C)C(N)=Nc1ccc(C)[nH]1.[H]/N=C(\N=C(N)N)N(C)c1ccc(C)[nH]1.[H]/N=C(\N=C(N)N)N(C)c1ccc(C)o1.
What is the InChIKey of 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine?
The InChIKey is MZLLNVDEOZVJRE-BGZOAVKZSA-N. The full InChI is InChI=1S/4C9H16N6.4C8H14N6.2C8H13N5O.C7H12N6.C7H11N5O/c1-6-4-5-7(12-6)13-8(10)14-9(11)15(2)3;1-6-4-5-7(13-6)15(3)9(11)14-8(10)12-2;1-6-4-5-7(13-6)14(2)9(12)15(3)8(10)11;1-6-4-5-7(13-6)15(3)9(12-2)14-8(10)11;1-5-3-4-6(12-5)13-8(10)14-7(9)11-2;1-5-3-4-6(12-5)14(2)8(11)13-7(9)10;1-5-3-4-6(12-5)13-8(11)14(2)7(9)10;1-5-3-4-6(12-5)13-8(11-2)14-7(9)10;1-5-3-4-6(14-5)13(2)8(11)12-7(9)10;1-5-3-4-6(14-5)12-8(11-2)13-7(9)10;1-4-2-3-5(11-4)12-7(10)13-6(8)9;1-4-2-3-5(13-4)11-7(10)12-6(8)9/h4-5,12H,1-3H3,(H4,10,11,13,14);4-5,13H,1-3H3,(H4,10,11,12,14);4-5,12-13H,1-3H3,(H3,10,11);4-5,13H,1-3H3,(H4,10,11,12,14);3-4,12H,1-2H3,(H5,9,10,11,13,14);3-4,12H,1-2H3,(H5,9,10,11,13);3-4,12H,1-2H3,(H3,9,10)(H2,11,13);3-4,12H,1-2H3,(H5,9,10,11,13,14);3-4H,1-2H3,(H5,9,10,11,12);3-4H,1-2H3,(H5,9,10,11,12,13);2-3,11H,1H3,(H6,8,9,10,12,13);2-3H,1H3,(H6,8,9,10,11,12)/b;;12-9-;;;;;;;;;.
What are the key properties of 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine?
1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine has a molecular weight of 2361.91 g/mol, XLogP of 0.59, 12 rotatable bonds, 42 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[amino-[(5-methyl-1H-pyrrol-2-yl)amino]methylidene]-2-methylguanidine;1-carbamimidoyl-1,3-dimethyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;1-carbamimidoyl-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1,2-dimethyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methylfuran-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methylfuran-2-yl)guanidine;1-(diaminomethylidene)-2-methyl-3-(5-methyl-1H-pyrrol-2-yl)guanidine;3-(diaminomethylidene)-1-methyl-1-(5-methyl-1H-pyrrol-2-yl)guanidine;1-(diaminomethylidene)-2-(5-methyl-1H-pyrrol-2-yl)guanidine;1,1-dimethyl-2-[N'-(5-methyl-1H-pyrrol-2-yl)carbamimidoyl]guanidine;1-methyl-2-(N'-methylcarbamimidoyl)-1-(5-methyl-1H-pyrrol-2-yl)guanidine is sourced from PubChem (CID 159716128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).