N-phenacylpyridine-2-carboxamide

C14H12N2O2 — CID 64991609

IUPACN-phenacylpyridine-2-carboxamide
SMILESO=C(CNC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C14H12N2O2/c17-13(11-6-2-1-3-7-11)10-16-14(18)12-8-4-5-9-15-12/h1-9H,10H2,(H,16,18)
InChIKeyXTHXWOPEHRWAJQ-UHFFFAOYSA-N
MW240.26 g/mol
LogP1.69
Rot. Bonds4

About N-phenacylpyridine-2-carboxamide

N-phenacylpyridine-2-carboxamide (PubChem CID 64991609) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-phenacylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-phenacylpyridine-2-carboxamide
PubChem CID64991609
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC NameN-phenacylpyridine-2-carboxamide
SMILESO=C(CNC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C14H12N2O2/c17-13(11-6-2-1-3-7-11)10-16-14(18)12-8-4-5-9-15-12/h1-9H,10H2,(H,16,18)
InChIKeyXTHXWOPEHRWAJQ-UHFFFAOYSA-N
XLogP1.69
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-phenacylpyridine-2-carboxamide
CID 64991922
2-(pyridine-2-carbonylamino)acetic acid;thiophene
CID 66951625
1-phenyl-5-pyridin-2-ylpentane-1,3,5-trione
CID 117060151
N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
CID 139125511
N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
CID 139125512
acetic acid;N-ethylpyridine-2-carboxamide
CID 174901243
N-[6-(pyridine-2-carbonylamino)hexyl]pyridine-2-carboxamide;hydrochloride
CID 54601367
N-(2-bromoethyl)pyridine-2-carboxamide
CID 12983473
N-(4-benzoylphenyl)pyridine-2-carboxamide
CID 157248993
6-(pyridine-2-carbonylamino)hexanoic acid
CID 16792895
N-[2-[N-[2-(pyridine-2-carbonylamino)ethyl]anilino]ethyl]pyridine-2-carboxamide
CID 139085666
N-(2-bromo-2-phenylethyl)pyridine-2-carboxamide
CID 114308424

Frequently Asked Questions

What is the IUPAC name of N-phenacylpyridine-2-carboxamide?
The IUPAC name of N-phenacylpyridine-2-carboxamide (CID 64991609) is N-phenacylpyridine-2-carboxamide.
What is the SMILES notation for N-phenacylpyridine-2-carboxamide?
The canonical SMILES for N-phenacylpyridine-2-carboxamide is O=C(CNC(=O)c1ccccn1)c1ccccc1.
What is the InChIKey of N-phenacylpyridine-2-carboxamide?
The InChIKey is XTHXWOPEHRWAJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c17-13(11-6-2-1-3-7-11)10-16-14(18)12-8-4-5-9-15-12/h1-9H,10H2,(H,16,18).
What are the key properties of N-phenacylpyridine-2-carboxamide?
N-phenacylpyridine-2-carboxamide has a molecular weight of 240.26 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenacylpyridine-2-carboxamide is sourced from PubChem (CID 64991609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).