4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide

C14H19ClN2O2 — CID 81226502

IUPAC4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
SMILESO=C(c1cnccc1Cl)N(CCO)C1CCCCC1
InChIInChI=1S/C14H19ClN2O2/c15-13-6-7-16-10-12(13)14(19)17(8-9-18)11-4-2-1-3-5-11/h6-7,10-11,18H,1-5,8-9H2
InChIKeyCMXQFFXBUIRLRK-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.50
Rot. Bonds4

About 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide

4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide (PubChem CID 81226502) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
PubChem CID81226502
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
SMILESO=C(c1cnccc1Cl)N(CCO)C1CCCCC1
InChIInChI=1S/C14H19ClN2O2/c15-13-6-7-16-10-12(13)14(19)17(8-9-18)11-4-2-1-3-5-11/h6-7,10-11,18H,1-5,8-9H2
InChIKeyCMXQFFXBUIRLRK-UHFFFAOYSA-N
XLogP2.50
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-cyclohexyl-5-hydroxy-N-(2-hydroxyethyl)benzamide
CID 106501618
4-chloro-N,N-bis(2-hydroxyethyl)pyridine-3-carboxamide
CID 81227403
N-(3-bromopropyl)-3-chloro-N-cyclobutylpyridine-4-carboxamide
CID 102872187
3-chloro-N-cyclohexyl-N-ethylpyridine-4-carboxamide
CID 66464797
2-chloro-N-cyclohexyl-N-(2-hydroxyethyl)-4-methylbenzamide
CID 106509715
N-(2-chloroethyl)-N-cyclohexyl-3-methylpyridine-4-carboxamide
CID 114278806
N-(2-chloroethyl)-N-cyclopentyl-3-hydroxypyridine-4-carboxamide
CID 81442647
1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
5-chloro-N-cyclohexyl-N-(2-hydroxyethyl)-2-(methylamino)benzamide
CID 62174801
2-amino-3-chloro-N-cyclobutyl-N-(2-hydroxyethyl)benzamide
CID 102858927
4-chloro-N-cyclopentyl-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 54994214
4-chloro-N-cyclopropyl-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 81229618

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide (CID 81226502) is 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide is O=C(c1cnccc1Cl)N(CCO)C1CCCCC1.
What is the InChIKey of 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
The InChIKey is CMXQFFXBUIRLRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c15-13-6-7-16-10-12(13)14(19)17(8-9-18)11-4-2-1-3-5-11/h6-7,10-11,18H,1-5,8-9H2.
What are the key properties of 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-cyclohexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81226502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).