5-chloro-N-phenacylpyridine-2-carboxamide

C14H11ClN2O2 — CID 64991922

IUPAC5-chloro-N-phenacylpyridine-2-carboxamide
SMILESO=C(CNC(=O)c1ccc(Cl)cn1)c1ccccc1
InChIInChI=1S/C14H11ClN2O2/c15-11-6-7-12(16-8-11)14(19)17-9-13(18)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,19)
InChIKeyDDYGWSZCBACEFH-UHFFFAOYSA-N
MW274.71 g/mol
LogP2.35
Rot. Bonds4

About 5-chloro-N-phenacylpyridine-2-carboxamide

5-chloro-N-phenacylpyridine-2-carboxamide (PubChem CID 64991922) has the molecular formula C14H11ClN2O2 and a molecular weight of 274.71 g/mol. Its IUPAC name is 5-chloro-N-phenacylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-phenacylpyridine-2-carboxamide
PubChem CID64991922
Molecular FormulaC14H11ClN2O2
Molecular Weight274.71 g/mol
Exact Mass274.05
IUPAC Name5-chloro-N-phenacylpyridine-2-carboxamide
SMILESO=C(CNC(=O)c1ccc(Cl)cn1)c1ccccc1
InChIInChI=1S/C14H11ClN2O2/c15-11-6-7-12(16-8-11)14(19)17-9-13(18)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,19)
InChIKeyDDYGWSZCBACEFH-UHFFFAOYSA-N
XLogP2.35
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.71
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenacylpyridine-2-carboxamide
CID 64991609
4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide
CID 732485
6-methyl-N-phenacylpyridine-3-carboxamide
CID 64991652
4-chloro-N-(phenacylcarbamothioyl)benzamide
CID 2294592
5-chloro-N-[[4-(hydroxymethyl)phenyl]methyl]pyridine-2-carboxamide
CID 107231717
5-chloro-N-(4-iodobutyl)pyridine-2-carboxamide
CID 106846441
3-fluoro-N-phenacylpyridine-4-carboxamide
CID 64991811
N-[2-oxo-2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 155676275
N-(2-bromo-1-phenylethyl)-5-chloropyridine-2-carboxamide
CID 113274731
5-chloro-N-[2-(chloromethyl)phenyl]pyridine-2-carboxamide
CID 113271900
(2S)-2-[[(5-chloropyridine-2-carbonyl)amino]methyl]-4-methylpentanoic acid
CID 124517125
1-methyl-N-phenacylpyrazole-4-carboxamide
CID 64991757

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-phenacylpyridine-2-carboxamide?
The IUPAC name of 5-chloro-N-phenacylpyridine-2-carboxamide (CID 64991922) is 5-chloro-N-phenacylpyridine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-phenacylpyridine-2-carboxamide?
The canonical SMILES for 5-chloro-N-phenacylpyridine-2-carboxamide is O=C(CNC(=O)c1ccc(Cl)cn1)c1ccccc1.
What is the InChIKey of 5-chloro-N-phenacylpyridine-2-carboxamide?
The InChIKey is DDYGWSZCBACEFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O2/c15-11-6-7-12(16-8-11)14(19)17-9-13(18)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,19).
What are the key properties of 5-chloro-N-phenacylpyridine-2-carboxamide?
5-chloro-N-phenacylpyridine-2-carboxamide has a molecular weight of 274.71 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-phenacylpyridine-2-carboxamide is sourced from PubChem (CID 64991922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).