2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide

C12H16ClN3O — CID 63279653

IUPAC2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide
SMILESCC1CCCC1NC(=O)c1cc(N)nc(Cl)c1
InChIInChI=1S/C12H16ClN3O/c1-7-3-2-4-9(7)15-12(17)8-5-10(13)16-11(14)6-8/h5-7,9H,2-4H2,1H3,(H2,14,16)(H,15,17)
InChIKeyFQZQYHRSZQPFDT-UHFFFAOYSA-N
MW253.73 g/mol
LogP2.24
Rot. Bonds2

About 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide

2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide (PubChem CID 63279653) has the molecular formula C12H16ClN3O and a molecular weight of 253.73 g/mol. Its IUPAC name is 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide
PubChem CID63279653
Molecular FormulaC12H16ClN3O
Molecular Weight253.73 g/mol
Exact Mass253.10
IUPAC Name2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide
SMILESCC1CCCC1NC(=O)c1cc(N)nc(Cl)c1
InChIInChI=1S/C12H16ClN3O/c1-7-3-2-4-9(7)15-12(17)8-5-10(13)16-11(14)6-8/h5-7,9H,2-4H2,1H3,(H2,14,16)(H,15,17)
InChIKeyFQZQYHRSZQPFDT-UHFFFAOYSA-N
XLogP2.24
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.73
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-6-hydrazinyl-N-(2-methylcyclohexyl)pyridine-4-carboxamide
CID 62248861
3,5-diamino-N-(2-methylcyclohexyl)benzamide
CID 61090027
2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide
CID 113246075
2-amino-6-chloro-N-(oxan-3-yl)pyridine-4-carboxamide
CID 55190561
2-amino-6-chloro-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 62161947
2-amino-6-chloro-N-(1-cyclohexylethyl)pyridine-4-carboxamide
CID 62407259
2-amino-N-(2,3-dimethylcyclohexyl)pyridine-4-carboxamide
CID 62156414
1-N,4-N-bis[(1S,2R)-2-methylcyclohexyl]benzene-1,4-dicarboxamide
CID 124805645
2,6-dichloro-N-[2-(hydroxymethyl)cyclohexyl]pyridine-4-carboxamide
CID 103860531
2,3-dimethyl-N-[(1S,2S)-2-methylcyclopentyl]quinoxaline-6-carboxamide
CID 95598062
2-chloro-N-(2,3-dimethylcyclopentyl)-6-methylpyridine-4-carboxamide
CID 113378456
2-amino-6-chloro-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 62159652

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide (CID 63279653) is 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide is CC1CCCC1NC(=O)c1cc(N)nc(Cl)c1.
What is the InChIKey of 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide?
The InChIKey is FQZQYHRSZQPFDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O/c1-7-3-2-4-9(7)15-12(17)8-5-10(13)16-11(14)6-8/h5-7,9H,2-4H2,1H3,(H2,14,16)(H,15,17).
What are the key properties of 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide?
2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide has a molecular weight of 253.73 g/mol, XLogP of 2.24, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide is sourced from PubChem (CID 63279653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).