4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide

C15H15ClN2O2 — CID 81226919

IUPAC4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)NC(CO)c2ccccc2)cn1
InChIInChI=1S/C15H15ClN2O2/c1-10-7-13(16)12(8-17-10)15(20)18-14(9-19)11-5-3-2-4-6-11/h2-8,14,19H,9H2,1H3,(H,18,20)
InChIKeyZOFXGIYKBOPYKU-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.51
Rot. Bonds4

About 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide

4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide (PubChem CID 81226919) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide
PubChem CID81226919
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)NC(CO)c2ccccc2)cn1
InChIInChI=1S/C15H15ClN2O2/c1-10-7-13(16)12(8-17-10)15(20)18-14(9-19)11-5-3-2-4-6-11/h2-8,14,19H,9H2,1H3,(H,18,20)
InChIKeyZOFXGIYKBOPYKU-UHFFFAOYSA-N
XLogP2.51
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-bromophenyl)propyl]-4-chloro-6-methylpyridine-3-carboxamide
CID 81229401
2-chloro-N-[(1R)-2-hydroxy-1-phenylethyl]benzamide
CID 39374837
N-(2-hydroxy-1-phenylethyl)-2,4-dimethylpyrimidine-5-carboxamide
CID 110001315
N-[(1S)-2-hydroxy-1-phenylethyl]-3,6-dimethylpyridazine-4-carboxamide
CID 103878997
4-amino-6-methyl-N-(1-phenylpropyl)pyridine-3-carboxamide
CID 81241004
2-chloro-N-[(1S)-2-hydroxy-1-phenylethyl]-3-methylbenzamide
CID 103945018
5-bromo-2-chloro-N-[(1R)-2-hydroxy-1-phenylethyl]benzamide
CID 103772690
N-[(1S)-2-hydroxy-1-phenylethyl]-5-methyl-1H-pyrazole-4-carboxamide
CID 103945112
3-fluoro-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-4-carboxamide
CID 113356364
N-[(1R)-2-hydroxy-1-phenylethyl]-1,3-dimethylpyrazole-4-carboxamide
CID 103772742
4-chloro-2-hydroxy-N-(2-hydroxy-1-phenylethyl)benzamide
CID 63182530
4-chloro-6-methyl-N-(3-methylpentan-2-yl)pyridine-3-carboxamide
CID 81226447

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide (CID 81226919) is 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide is Cc1cc(Cl)c(C(=O)NC(CO)c2ccccc2)cn1.
What is the InChIKey of 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide?
The InChIKey is ZOFXGIYKBOPYKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-7-13(16)12(8-17-10)15(20)18-14(9-19)11-5-3-2-4-6-11/h2-8,14,19H,9H2,1H3,(H,18,20).
What are the key properties of 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide?
4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide has a molecular weight of 290.75 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-hydroxy-1-phenylethyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81226919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).