6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide

C13H17ClN2O2 — CID 55211893

IUPAC6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
SMILESO=C(c1cccc(Cl)n1)N(CCO)C1CCCC1
InChIInChI=1S/C13H17ClN2O2/c14-12-7-3-6-11(15-12)13(18)16(8-9-17)10-4-1-2-5-10/h3,6-7,10,17H,1-2,4-5,8-9H2
InChIKeyJRBANAZRSJEOGS-UHFFFAOYSA-N
MW268.74 g/mol
LogP2.11
Rot. Bonds4

About 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide

6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide (PubChem CID 55211893) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
PubChem CID55211893
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC Name6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
SMILESO=C(c1cccc(Cl)n1)N(CCO)C1CCCC1
InChIInChI=1S/C13H17ClN2O2/c14-12-7-3-6-11(15-12)13(18)16(8-9-17)10-4-1-2-5-10/h3,6-7,10,17H,1-2,4-5,8-9H2
InChIKeyJRBANAZRSJEOGS-UHFFFAOYSA-N
XLogP2.11
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 54994544
1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
N-cyclopentyl-3-hydroxy-N-(2-hydroxyethyl)benzamide
CID 54994210
3-chloro-N-cyclopropyl-N-(2-hydroxyethyl)benzamide
CID 43576965
2-amino-3-chloro-N-cyclobutyl-N-(2-hydroxyethyl)benzamide
CID 102858927
4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 81226502
6-chloro-N-cyclopropyl-N-(oxolan-3-ylmethyl)pyridine-2-carboxamide
CID 55052541
2-chloro-N-cyclobutyl-6-hydrazinyl-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 102870600
2-amino-N-cyclobutyl-N-(2-hydroxyethyl)-1,3-thiazole-4-carboxamide
CID 102861928
N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 102684996
3-chloro-N-cyclobutyl-N-(2-hydroxyethyl)-4-iodobenzamide
CID 102685010
6-chloro-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 55052209

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide (CID 55211893) is 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide is O=C(c1cccc(Cl)n1)N(CCO)C1CCCC1.
What is the InChIKey of 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide?
The InChIKey is JRBANAZRSJEOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O2/c14-12-7-3-6-11(15-12)13(18)16(8-9-17)10-4-1-2-5-10/h3,6-7,10,17H,1-2,4-5,8-9H2.
What are the key properties of 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide?
6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide has a molecular weight of 268.74 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide is sourced from PubChem (CID 55211893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).