N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide

C15H15ClN2O2 — CID 47468190

IUPACN-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide
SMILESCOc1ccc(NC(=O)CCc2ccccn2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-20-14-7-5-12(10-13(14)16)18-15(19)8-6-11-4-2-3-9-17-11/h2-5,7,9-10H,6,8H2,1H3,(H,18,19)
InChIKeyNAHLPQVSGKYMPE-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.31
Rot. Bonds5

About N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide

N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide (PubChem CID 47468190) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide
PubChem CID47468190
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide
SMILESCOc1ccc(NC(=O)CCc2ccccn2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-20-14-7-5-12(10-13(14)16)18-15(19)8-6-11-4-2-3-9-17-11/h2-5,7,9-10H,6,8H2,1H3,(H,18,19)
InChIKeyNAHLPQVSGKYMPE-UHFFFAOYSA-N
XLogP3.31
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-chloro-4-[2-(diethylamino)ethoxy]phenyl]-3-pyridin-2-ylpropanamide
CID 141088419
N-(3-chloro-4-methoxyphenyl)-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110329818
N-(3-chloro-4-methoxyphenyl)-2-[2-(2-pyridin-2-ylethyl)-1,3-thiazol-4-yl]acetamide
CID 110389576
2-[acetyl(pyridin-2-ylmethyl)amino]-N-(3-chloro-4-methoxyphenyl)acetamide
CID 113163474
N,N'-bis(3-chloro-4-methoxyphenyl)hexanediamide
CID 4945268
N-[4-methoxy-3-(5-methyltetrazol-1-yl)phenyl]-3-pyridin-2-ylpropanamide
CID 134813273
4-N-(3-chloro-4-methoxyphenyl)-1-N-(pyridin-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109047587
N-(3-chloro-4-methoxyphenyl)butanamide
CID 875969
N-(3-chloro-4-methoxyphenyl)-2-(pyridin-2-ylmethylamino)pyrimidine-5-carboxamide
CID 109258745
N-(3,4-dimethoxyphenyl)-3-(pyridin-2-ylmethylamino)propanamide
CID 109023408
N-(3-chloro-4-methoxyphenyl)-4-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 113108333
N-(3-chloro-4-methoxyphenyl)-3-(2-methylphenoxy)propanamide
CID 2110283

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide (CID 47468190) is N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide is COc1ccc(NC(=O)CCc2ccccn2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide?
The InChIKey is NAHLPQVSGKYMPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-20-14-7-5-12(10-13(14)16)18-15(19)8-6-11-4-2-3-9-17-11/h2-5,7,9-10H,6,8H2,1H3,(H,18,19).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide?
N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide has a molecular weight of 290.75 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-3-pyridin-2-ylpropanamide is sourced from PubChem (CID 47468190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).