N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide

C15H13ClN2O — CID 139125512

IUPACN-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
SMILESO=C(NC/C(Cl)=C/c1ccccc1)c1ccccn1
InChIInChI=1S/C15H13ClN2O/c16-13(10-12-6-2-1-3-7-12)11-18-15(19)14-8-4-5-9-17-14/h1-10H,11H2,(H,18,19)/b13-10-
InChIKeySYTBQLUFIYFMOC-RAXLEYEMSA-N
MW272.74 g/mol
LogP3.09
Rot. Bonds4

About N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide

N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide (PubChem CID 139125512) has the molecular formula C15H13ClN2O and a molecular weight of 272.74 g/mol. Its IUPAC name is N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
PubChem CID139125512
Molecular FormulaC15H13ClN2O
Molecular Weight272.74 g/mol
Exact Mass272.07
IUPAC NameN-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
SMILESO=C(NC/C(Cl)=C/c1ccccc1)c1ccccn1
InChIInChI=1S/C15H13ClN2O/c16-13(10-12-6-2-1-3-7-12)11-18-15(19)14-8-4-5-9-17-14/h1-10H,11H2,(H,18,19)/b13-10-
InChIKeySYTBQLUFIYFMOC-RAXLEYEMSA-N
XLogP3.09
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide
CID 139125511
N-phenacylpyridine-2-carboxamide
CID 64991609
2-(pyridine-2-carbonylamino)acetic acid;thiophene
CID 66951625
N-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl]pyridine-2-carboxamide
CID 108574860
acetic acid;N-ethylpyridine-2-carboxamide
CID 174901243
N-(2,2-difluoro-2-phenylethyl)pyridine-2-carboxamide
CID 162399417
N-[6-(pyridine-2-carbonylamino)hexyl]pyridine-2-carboxamide;hydrochloride
CID 54601367
N-(2-bromoethyl)pyridine-2-carboxamide
CID 12983473
(E)-2-phenyl-1-pyridin-2-ylethenol
CID 23039790
1-[2-(pyridine-2-carbonylamino)acetyl]piperidine-4-carboxylic acid
CID 119349505
N-(9-oxononyl)pyridine-2-carboxamide
CID 130335282
(E)-but-2-enedioic acid;N-[3-[3-(pyridine-2-carbonylamino)propylamino]propyl]pyridine-2-carboxamide
CID 155880885

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide?
The IUPAC name of N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide (CID 139125512) is N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide?
The canonical SMILES for N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide is O=C(NC/C(Cl)=C/c1ccccc1)c1ccccn1.
What is the InChIKey of N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide?
The InChIKey is SYTBQLUFIYFMOC-RAXLEYEMSA-N. The full InChI is InChI=1S/C15H13ClN2O/c16-13(10-12-6-2-1-3-7-12)11-18-15(19)14-8-4-5-9-17-14/h1-10H,11H2,(H,18,19)/b13-10-.
What are the key properties of N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide?
N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide has a molecular weight of 272.74 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-chloro-3-phenylprop-2-enyl]pyridine-2-carboxamide is sourced from PubChem (CID 139125512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).