2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide

C21H20N2O2 — CID 4512766

IUPAC2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1cccnc1
InChIInChI=1S/C21H20N2O2/c1-16(21(24)23-15-17-6-5-13-22-14-17)25-20-11-9-19(10-12-20)18-7-3-2-4-8-18/h2-14,16H,15H2,1H3,(H,23,24)
InChIKeyVLYAEZGZCGCQHC-UHFFFAOYSA-N
MW332.40 g/mol
LogP3.83
Rot. Bonds6

About 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide

2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 4512766) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
PubChem CID4512766
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC Name2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1cccnc1
InChIInChI=1S/C21H20N2O2/c1-16(21(24)23-15-17-6-5-13-22-14-17)25-20-11-9-19(10-12-20)18-7-3-2-4-8-18/h2-14,16H,15H2,1H3,(H,23,24)
InChIKeyVLYAEZGZCGCQHC-UHFFFAOYSA-N
XLogP3.83
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-propan-2-ylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 25236333
(2S)-2-(4-chlorophenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 800409
(2S)-2-(4-fluorophenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 40624060
2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)butanamide
CID 17199653
(2R)-2-(4-tert-butylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 40609627
2-(3-methylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 21366996
(2R)-2-(3-fluorophenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 31882488
(2S)-2-phenoxy-N-(pyridin-4-ylmethyl)propanamide
CID 670240
(2R)-2-(4-chloro-3-methylphenoxy)-N-(pyridin-3-ylmethyl)propanamide
CID 890845
2-phenylmethoxy-N-(pyridin-3-ylmethyl)propanamide
CID 42959352
(2R)-2-phenoxy-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 93234508
(2R)-N-[(4-methylphenyl)methyl]-2-phenoxypropanamide
CID 670065

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide (CID 4512766) is 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide is CC(Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1cccnc1.
What is the InChIKey of 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is VLYAEZGZCGCQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-16(21(24)23-15-17-6-5-13-22-14-17)25-20-11-9-19(10-12-20)18-7-3-2-4-8-18/h2-14,16H,15H2,1H3,(H,23,24).
What are the key properties of 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide?
2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 332.40 g/mol, XLogP of 3.83, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenoxy)-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 4512766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).