N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide

C15H16ClN5O — CID 122423281

IUPACN-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide
SMILESCc1c(NC(=O)c2cccnc2NC2CC2)cnc(Cl)c1N
InChIInChI=1S/C15H16ClN5O/c1-8-11(7-19-13(16)12(8)17)21-15(22)10-3-2-6-18-14(10)20-9-4-5-9/h2-3,6-7,9H,4-5,17H2,1H3,(H,18,20)(H,21,22)
InChIKeyNQDAMZVERYOVEP-UHFFFAOYSA-N
MW317.78 g/mol
LogP2.85
Rot. Bonds4

About N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide

N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide (PubChem CID 122423281) has the molecular formula C15H16ClN5O and a molecular weight of 317.78 g/mol. Its IUPAC name is N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide
PubChem CID122423281
Molecular FormulaC15H16ClN5O
Molecular Weight317.78 g/mol
Exact Mass317.10
IUPAC NameN-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide
SMILESCc1c(NC(=O)c2cccnc2NC2CC2)cnc(Cl)c1N
InChIInChI=1S/C15H16ClN5O/c1-8-11(7-19-13(16)12(8)17)21-15(22)10-3-2-6-18-14(10)20-9-4-5-9/h2-3,6-7,9H,4-5,17H2,1H3,(H,18,20)(H,21,22)
InChIKeyNQDAMZVERYOVEP-UHFFFAOYSA-N
XLogP2.85
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.78
LogP ≤ 52.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-chloroisoquinolin-4-yl)-2-(cyclopropylamino)pyridine-3-carboxamide
CID 10735787
2-(cyclopropylamino)-N-(2,5-difluorophenyl)pyridine-3-carboxamide
CID 84574316
2-(cyclopropylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 84574880
methyl 2-(cyclopropylamino)pyridine-3-carboxylate
CID 60722666
2-(cyclopropylamino)-N-(3,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 84574680
ethyl 2-[(4-carbamoylcyclohexyl)amino]pyridine-3-carboxylate
CID 61044227
2-(cyclopropylamino)-N-prop-2-enylpyridine-3-carboxamide
CID 84574884
2-chloro-N-[2-(cyclopropylamino)-4-methyl-3-pyridinyl]-5-nitropyridine-3-carboxamide
CID 10641418
2-(cyclopentylamino)-N-(2-methylquinolin-6-yl)pyridine-3-carboxamide
CID 166361415
methyl 2-[(3-methoxycyclopentyl)amino]pyridine-3-carboxylate
CID 103082179
2-(cycloheptylamino)pyridine-3-carboxylic acid
CID 43236673
2-(cyclopentylamino)-N-(6-methyl-1H-benzimidazol-2-yl)pyridine-3-carboxamide
CID 167799599

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide?
The IUPAC name of N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide (CID 122423281) is N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide is Cc1c(NC(=O)c2cccnc2NC2CC2)cnc(Cl)c1N.
What is the InChIKey of N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide?
The InChIKey is NQDAMZVERYOVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN5O/c1-8-11(7-19-13(16)12(8)17)21-15(22)10-3-2-6-18-14(10)20-9-4-5-9/h2-3,6-7,9H,4-5,17H2,1H3,(H,18,20)(H,21,22).
What are the key properties of N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide?
N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide has a molecular weight of 317.78 g/mol, XLogP of 2.85, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-6-chloro-4-methyl-3-pyridinyl)-2-(cyclopropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 122423281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).