2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide

C14H19ClN2O2 — CID 113378437

IUPAC2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NCCOC2CCCC2)cc(Cl)n1
InChIInChI=1S/C14H19ClN2O2/c1-10-8-11(9-13(15)17-10)14(18)16-6-7-19-12-4-2-3-5-12/h8-9,12H,2-7H2,1H3,(H,16,18)
InChIKeyDQZIMXJIJKXCHN-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.73
Rot. Bonds5

About 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide

2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide (PubChem CID 113378437) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide
PubChem CID113378437
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NCCOC2CCCC2)cc(Cl)n1
InChIInChI=1S/C14H19ClN2O2/c1-10-8-11(9-13(15)17-10)14(18)16-6-7-19-12-4-2-3-5-12/h8-9,12H,2-7H2,1H3,(H,16,18)
InChIKeyDQZIMXJIJKXCHN-UHFFFAOYSA-N
XLogP2.73
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-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-cyclopentyloxypropyl)-2,6-dimethylpyridine-4-carboxamide
CID 77084205
2-chloro-N-(2-cyclohexylethyl)-6-methylpyridine-4-carboxamide
CID 113378333
4-amino-3,5-dichloro-N-(2-cyclopentyloxyethyl)benzamide
CID 82833373
2-chloro-6-methyl-N-[2-(oxan-2-yl)ethyl]pyridine-4-carboxamide
CID 104952816
N-(2-cyclopentyloxyethyl)-3,5-dihydroxybenzamide
CID 104938884
3,5-dibromo-N-(2-cyclopentyloxyethyl)benzamide
CID 103908078
5-chloro-N-(2-cyclopentyloxyethyl)-6-(methylamino)pyridine-3-carboxamide
CID 63834843
2-chloro-N-ethyl-6-methylpyridine-4-carboxamide
CID 89150895
2-amino-N-(2-cyclopentyloxyethyl)pyridine-4-carboxamide
CID 63834137
2-chloro-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
CID 107417821
N-[2-(4-aminocyclohexyl)oxyethyl]-2-methylpyridine-4-carboxamide
CID 106753638
N-(2-cyclohexyloxyethyl)-2-(methylamino)pyridine-4-carboxamide
CID 63834324

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide?
The IUPAC name of 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide (CID 113378437) is 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide?
The canonical SMILES for 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide is Cc1cc(C(=O)NCCOC2CCCC2)cc(Cl)n1.
What is the InChIKey of 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide?
The InChIKey is DQZIMXJIJKXCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-10-8-11(9-13(15)17-10)14(18)16-6-7-19-12-4-2-3-5-12/h8-9,12H,2-7H2,1H3,(H,16,18).
What are the key properties of 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide?
2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-cyclopentyloxyethyl)-6-methylpyridine-4-carboxamide is sourced from PubChem (CID 113378437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).