4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one

C78H63ClN24O6 — CID 165098566

IUPAC4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one
SMILESCc1c(N)ccc2[nH]ccc12.Cc1c(Nc2nc(-c3ccncc3)nc3ccncc23)ccc2[nH]ccc12.Clc1nc(-c2ccncc2)nc2ccncc12.NC(=O)c1cnccc1N.NC(=O)c1cnccc1NC(=O)c1ccncc1.O=C(O)c1ccncc1.O=c1[nH]c(-c2ccncc2)nc2ccncc12
InChIInChI=1S/C21H16N6.C12H7ClN4.C12H10N4O2.C12H8N4O.C9H10N2.C6H7N3O.C6H5NO2/c1-13-15-6-11-24-18(15)3-2-17(13)25-21-16-12-23-10-7-19(16)26-20(27-21)14-4-8-22-9-5-14;13-11-9-7-15-6-3-10(9)16-12(17-11)8-1-4-14-5-2-8;13-11(17)9-7-15-6-3-10(9)16-12(18)8-1-4-14-5-2-8;17-12-9-7-14-6-3-10(9)15-11(16-12)8-1-4-13-5-2-8;1-6-7-4-5-11-9(7)3-2-8(6)10;7-5-1-2-9-3-4(5)6(8)10;8-6(9)5-1-3-7-4-2-5/h2-12,24H,1H3,(H,25,26,27);1-7H;1-7H,(H2,13,17)(H,15,16,18);1-7H,(H,15,16,17);2-5,11H,10H2,1H3;1-3H,(H2,7,9)(H2,8,10);1-4H,(H,8,9)
InChIKeyXXUKTYVZWLOKGR-UHFFFAOYSA-N
MW1467.98 g/mol
LogP12.17
Rot. Bonds10

About 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one

4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one (PubChem CID 165098566) has the molecular formula C78H63ClN24O6 and a molecular weight of 1467.98 g/mol. Its IUPAC name is 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one
PubChem CID165098566
Molecular FormulaC78H63ClN24O6
Molecular Weight1467.98 g/mol
Exact Mass1466.51
IUPAC Name4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one
SMILESCc1c(N)ccc2[nH]ccc12.Cc1c(Nc2nc(-c3ccncc3)nc3ccncc23)ccc2[nH]ccc12.Clc1nc(-c2ccncc2)nc2ccncc12.NC(=O)c1cnccc1N.NC(=O)c1cnccc1NC(=O)c1ccncc1.O=C(O)c1ccncc1.O=c1[nH]c(-c2ccncc2)nc2ccncc12
InChIInChI=1S/C21H16N6.C12H7ClN4.C12H10N4O2.C12H8N4O.C9H10N2.C6H7N3O.C6H5NO2/c1-13-15-6-11-24-18(15)3-2-17(13)25-21-16-12-23-10-7-19(16)26-20(27-21)14-4-8-22-9-5-14;13-11-9-7-15-6-3-10(9)16-12(17-11)8-1-4-14-5-2-8;13-11(17)9-7-15-6-3-10(9)16-12(18)8-1-4-14-5-2-8;17-12-9-7-14-6-3-10(9)15-11(16-12)8-1-4-13-5-2-8;1-6-7-4-5-11-9(7)3-2-8(6)10;7-5-1-2-9-3-4(5)6(8)10;8-6(9)5-1-3-7-4-2-5/h2-12,24H,1H3,(H,25,26,27);1-7H;1-7H,(H2,13,17)(H,15,16,18);1-7H,(H,15,16,17);2-5,11H,10H2,1H3;1-3H,(H2,7,9)(H2,8,10);1-4H,(H,8,9)
InChIKeyXXUKTYVZWLOKGR-UHFFFAOYSA-N
XLogP12.17
TPSA474.44 Ų
H-Bond Donors10
H-Bond Acceptors23
Rotatable Bonds10
Heavy Atoms109
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001467.98
LogP ≤ 512.17
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one?
The IUPAC name of 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one (CID 165098566) is 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one.
What is the SMILES notation for 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one?
The canonical SMILES for 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one is Cc1c(N)ccc2[nH]ccc12.Cc1c(Nc2nc(-c3ccncc3)nc3ccncc23)ccc2[nH]ccc12.Clc1nc(-c2ccncc2)nc2ccncc12.NC(=O)c1cnccc1N.NC(=O)c1cnccc1NC(=O)c1ccncc1.O=C(O)c1ccncc1.O=c1[nH]c(-c2ccncc2)nc2ccncc12.
What is the InChIKey of 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one?
The InChIKey is XXUKTYVZWLOKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N6.C12H7ClN4.C12H10N4O2.C12H8N4O.C9H10N2.C6H7N3O.C6H5NO2/c1-13-15-6-11-24-18(15)3-2-17(13)25-21-16-12-23-10-7-19(16)26-20(27-21)14-4-8-22-9-5-14;13-11-9-7-15-6-3-10(9)16-12(17-11)8-1-4-14-5-2-8;13-11(17)9-7-15-6-3-10(9)16-12(18)8-1-4-14-5-2-8;17-12-9-7-14-6-3-10(9)15-11(16-12)8-1-4-13-5-2-8;1-6-7-4-5-11-9(7)3-2-8(6)10;7-5-1-2-9-3-4(5)6(8)10;8-6(9)5-1-3-7-4-2-5/h2-12,24H,1H3,(H,25,26,27);1-7H;1-7H,(H2,13,17)(H,15,16,18);1-7H,(H,15,16,17);2-5,11H,10H2,1H3;1-3H,(H2,7,9)(H2,8,10);1-4H,(H,8,9).
What are the key properties of 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one?
4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one has a molecular weight of 1467.98 g/mol, XLogP of 12.17, 10 rotatable bonds, 10 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 4-aminopyridine-3-carboxamide;4-chloro-2-pyridin-4-ylpyrido[4,3-d]pyrimidine;4-methyl-1H-indol-5-amine;N-(4-methyl-1H-indol-5-yl)-2-pyridin-4-ylpyrido[4,3-d]pyrimidin-4-amine;4-(pyridine-4-carbonylamino)pyridine-3-carboxamide;pyridine-4-carboxylic acid;2-pyridin-4-yl-3H-pyrido[4,3-d]pyrimidin-4-one is sourced from PubChem (CID 165098566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).