N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide

C19H15ClN2O2 — CID 58533794

IUPACN-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(COc2ccccc2)nc1
InChIInChI=1S/C19H15ClN2O2/c20-15-7-10-16(11-8-15)22-19(23)14-6-9-17(21-12-14)13-24-18-4-2-1-3-5-18/h1-12H,13H2,(H,22,23)
InChIKeyQNHWKHQVPQYWMD-UHFFFAOYSA-N
MW338.79 g/mol
LogP4.57
Rot. Bonds5

About N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide

N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide (PubChem CID 58533794) has the molecular formula C19H15ClN2O2 and a molecular weight of 338.79 g/mol. Its IUPAC name is N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide
PubChem CID58533794
Molecular FormulaC19H15ClN2O2
Molecular Weight338.79 g/mol
Exact Mass338.08
IUPAC NameN-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(COc2ccccc2)nc1
InChIInChI=1S/C19H15ClN2O2/c20-15-7-10-16(11-8-15)22-19(23)14-6-9-17(21-12-14)13-24-18-4-2-1-3-5-18/h1-12H,13H2,(H,22,23)
InChIKeyQNHWKHQVPQYWMD-UHFFFAOYSA-N
XLogP4.57
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.79
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-[4-(phenoxymethyl)phenyl]benzamide
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4-[(2-chlorophenyl)methoxy]-N-(4-phenoxyphenyl)benzamide
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N-(4-chlorophenyl)benzamide;hydrochloride
CID 139912610
3,5-dichloro-N-[4-(2-phenoxyethoxy)phenyl]benzamide
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4-chloro-N-[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 11078012
N-(4-chlorophenyl)-6-(2-methoxyanilino)pyridine-3-carboxamide
CID 109163500
N-(4-anilinophenyl)-4-chlorobenzamide
CID 681104
4-[(2-chlorophenyl)methoxy]-N-phenylbenzamide
CID 8813243
4-[4-[(4-chlorophenyl)carbamoyl]phenoxy]butanoic acid
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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide (CID 58533794) is N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide is O=C(Nc1ccc(Cl)cc1)c1ccc(COc2ccccc2)nc1.
What is the InChIKey of N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
The InChIKey is QNHWKHQVPQYWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O2/c20-15-7-10-16(11-8-15)22-19(23)14-6-9-17(21-12-14)13-24-18-4-2-1-3-5-18/h1-12H,13H2,(H,22,23).
What are the key properties of N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide?
N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide has a molecular weight of 338.79 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-6-(phenoxymethyl)pyridine-3-carboxamide is sourced from PubChem (CID 58533794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).