5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine

C70H72N24O4S — CID 159569459

IUPAC5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine
SMILESCS(=O)(=O)c1ccc(-c2ccncc2N)nc1.Cn1c(-c2ccncc2N)cccc1=O.Cn1cc(-c2ccncc2N)ccc1=O.Cn1ccnc1-c1ccncc1N.Cn1cncc1-c1ccncc1N.Cn1nccc1-c1ccncc1N.Nc1cnccc1-c1ccccn1
InChIInChI=1S/C11H11N3O2S.2C11H11N3O.C10H9N3.3C9H10N4/c1-17(15,16)8-2-3-11(14-6-8)9-4-5-13-7-10(9)12;1-14-7-8(2-3-11(14)15)9-4-5-13-6-10(9)12;1-14-10(3-2-4-11(14)15)8-5-6-13-7-9(8)12;11-9-7-12-6-4-8(9)10-3-1-2-5-13-10;1-13-9(3-5-12-13)7-2-4-11-6-8(7)10;1-13-6-12-5-9(13)7-2-3-11-4-8(7)10;1-13-5-4-12-9(13)7-2-3-11-6-8(7)10/h2-7H,12H2,1H3;2*2-7H,12H2,1H3;1-7H,11H2;3*2-6H,10H2,1H3
InChIKeyMHPZVDCQVGNNBN-UHFFFAOYSA-N
MW1345.58 g/mol
LogP8.11
Rot. Bonds8

About 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine

5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine (PubChem CID 159569459) has the molecular formula C70H72N24O4S and a molecular weight of 1345.58 g/mol. Its IUPAC name is 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine.

Molecular Properties

Compound Name5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine
PubChem CID159569459
Molecular FormulaC70H72N24O4S
Molecular Weight1345.58 g/mol
Exact Mass1344.59
IUPAC Name5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine
SMILESCS(=O)(=O)c1ccc(-c2ccncc2N)nc1.Cn1c(-c2ccncc2N)cccc1=O.Cn1cc(-c2ccncc2N)ccc1=O.Cn1ccnc1-c1ccncc1N.Cn1cncc1-c1ccncc1N.Cn1nccc1-c1ccncc1N.Nc1cnccc1-c1ccccn1
InChIInChI=1S/C11H11N3O2S.2C11H11N3O.C10H9N3.3C9H10N4/c1-17(15,16)8-2-3-11(14-6-8)9-4-5-13-7-10(9)12;1-14-7-8(2-3-11(14)15)9-4-5-13-6-10(9)12;1-14-10(3-2-4-11(14)15)8-5-6-13-7-9(8)12;11-9-7-12-6-4-8(9)10-3-1-2-5-13-10;1-13-9(3-5-12-13)7-2-4-11-6-8(7)10;1-13-6-12-5-9(13)7-2-3-11-4-8(7)10;1-13-5-4-12-9(13)7-2-3-11-6-8(7)10/h2-7H,12H2,1H3;2*2-7H,12H2,1H3;1-7H,11H2;3*2-6H,10H2,1H3
InChIKeyMHPZVDCQVGNNBN-UHFFFAOYSA-N
XLogP8.11
TPSA429.75 Ų
H-Bond Donors7
H-Bond Acceptors28
Rotatable Bonds8
Heavy Atoms99
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001345.58
LogP ≤ 58.11
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1028

Analyze 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine with MolForge

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Related Compounds

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(E)-N-[2-(2-methylimidazol-1-yl)ethyl]-3-[1-(4-methylsulfonylphenyl)-3-pyridin-3-ylpyrazol-4-yl]prop-2-enamide
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(E)-N-[2-(2-methylimidazol-1-yl)ethyl]-3-[1-(4-methylsulfonylphenyl)-3-pyridin-4-ylpyrazol-4-yl]prop-2-enamide
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(E)-N-[3-(2-methylimidazol-1-yl)propyl]-3-[1-(4-methylsulfonylphenyl)-3-pyridin-4-ylpyrazol-4-yl]prop-2-enamide
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(E)-N-(3-imidazol-1-ylpropyl)-3-[1-(4-methylsulfonylphenyl)-3-pyridin-3-ylpyrazol-4-yl]prop-2-enamide
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4-[(1R,5S)-3-[7-amino-3-[6-(2-fluorophenyl)-3-pyridinyl]-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-5-yl]-8-azabicyclo[3.2.1]octane-8-carbonyl]-N'-[3-(dimethylamino)propyl]-N-ethyltriazole-2-carboximidamide
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N-[5-(1-methylpyrazol-4-yl)pyrazin-2-yl]-N-[4-[[4-(5-methylsulfonyl-3-pyridinyl)-5-(trifluoromethyl)pyrimidin-2-yl]amino]cyclohexyl]butanamide
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N,1-dimethyl-N-(5-methyl-6-propan-2-yl-3-pyridinyl)cyclopropane-1-carboxamide;1,3-dimethyl-5-propan-2-ylpyrazole;1-ethyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;N-methyl-N-(4-methyl-5-propan-2-yl-2-pyridinyl)acetamide;N-methyl-N-(5-methyl-6-propan-2-yl-3-pyridinyl)cyclopropanecarboxamide;N-methyl-N-(4-methyl-5-propan-2-ylpyrimidin-2-yl)cyclopropanecarboxamide;1-methyl-5-propan-2-yl-3-(2,2,2-trifluoroethyl)pyrazole;5-methylsulfonyl-2-propan-2-ylpyrimidine;N,2,2-trimethyl-N-(4-methyl-5-propan-2-ylpyrimidin-2-yl)propanamide;N,N,1-trimethyl-2-propan-2-ylpyrimidin-1-ium-5-amine
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2-(2,2-Dimethylpropyl)-6-ethylsulfonylpyridine;2-(2,2-dimethylpropyl)-1-methylimidazole;5-(2,2-dimethylpropyl)-1-methylimidazole;4-(2,2-dimethylpropyl)-1-methylpyrazole;5-(2,2-dimethylpropyl)-2-methylpyridine;2-(2,2-dimethylpropyl)-6-methylsulfanylpyridine;2-(2,2-dimethylpropyl)-1-oxidopyridin-1-ium;4-(2,2-dimethylpropyl)pyrimidine;5-(2,2-dimethylpropyl)-2-(trifluoromethyl)pyridine
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CID 159531993
5-tert-butyl-N,N,4-trimethylpyrimidin-2-amine;N,1-dimethyl-N-(4-methyl-5-propan-2-yl-2-pyridinyl)cyclopropane-1-carboxamide;1,3-dimethyl-5-propan-2-ylpyrazole;1-ethyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;N-methyl-N-(4-methyl-5-propan-2-yl-2-pyridinyl)acetamide;N-methyl-N-(4-methyl-5-propan-2-yl-2-pyridinyl)cyclopropanecarboxamide;N-methyl-N-(4-methyl-5-propan-2-ylpyrimidin-2-yl)cyclopropanecarboxamide;1-methyl-5-propan-2-yl-3-(2,2,2-trifluoroethyl)pyrazole;5-methylsulfonyl-2-propan-2-ylpyrimidine;N,2,2-trimethyl-N-(4-methyl-5-propan-2-ylpyrimidin-2-yl)propanamide
CID 161947664

Frequently Asked Questions

What is the IUPAC name of 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine?
The IUPAC name of 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine (CID 159569459) is 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine.
What is the SMILES notation for 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine?
The canonical SMILES for 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine is CS(=O)(=O)c1ccc(-c2ccncc2N)nc1.Cn1c(-c2ccncc2N)cccc1=O.Cn1cc(-c2ccncc2N)ccc1=O.Cn1ccnc1-c1ccncc1N.Cn1cncc1-c1ccncc1N.Cn1nccc1-c1ccncc1N.Nc1cnccc1-c1ccccn1.
What is the InChIKey of 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine?
The InChIKey is MHPZVDCQVGNNBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2S.2C11H11N3O.C10H9N3.3C9H10N4/c1-17(15,16)8-2-3-11(14-6-8)9-4-5-13-7-10(9)12;1-14-7-8(2-3-11(14)15)9-4-5-13-6-10(9)12;1-14-10(3-2-4-11(14)15)8-5-6-13-7-9(8)12;11-9-7-12-6-4-8(9)10-3-1-2-5-13-10;1-13-9(3-5-12-13)7-2-4-11-6-8(7)10;1-13-6-12-5-9(13)7-2-3-11-4-8(7)10;1-13-5-4-12-9(13)7-2-3-11-6-8(7)10/h2-7H,12H2,1H3;2*2-7H,12H2,1H3;1-7H,11H2;3*2-6H,10H2,1H3.
What are the key properties of 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine?
5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine has a molecular weight of 1345.58 g/mol, XLogP of 8.11, 8 rotatable bonds, 7 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;6-(3-amino-4-pyridinyl)-1-methylpyridin-2-one;4-(1-methylimidazol-2-yl)pyridin-3-amine;4-(3-methylimidazol-4-yl)pyridin-3-amine;4-(2-methylpyrazol-3-yl)pyridin-3-amine;4-(5-methylsulfonyl-2-pyridinyl)pyridin-3-amine;4-pyridin-2-ylpyridin-3-amine is sourced from PubChem (CID 159569459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).