2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide

C22H22N2O2 — CID 46408411

IUPAC2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NC(C)c1ccccn1
InChIInChI=1S/C22H22N2O2/c1-16(21-10-6-7-15-23-21)24-22(25)17(2)26-20-13-11-19(12-14-20)18-8-4-3-5-9-18/h3-17H,1-2H3,(H,24,25)
InChIKeyXMSDMQGVZGESDI-UHFFFAOYSA-N
MW346.43 g/mol
LogP4.39
Rot. Bonds6

About 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide

2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide (PubChem CID 46408411) has the molecular formula C22H22N2O2 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound Name2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide
PubChem CID46408411
Molecular FormulaC22H22N2O2
Molecular Weight346.43 g/mol
Exact Mass346.17
IUPAC Name2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NC(C)c1ccccn1
InChIInChI=1S/C22H22N2O2/c1-16(21-10-6-7-15-23-21)24-22(25)17(2)26-20-13-11-19(12-14-20)18-8-4-3-5-9-18/h3-17H,1-2H3,(H,24,25)
InChIKeyXMSDMQGVZGESDI-UHFFFAOYSA-N
XLogP4.39
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzhydryl-2-(4-phenylphenoxy)propanamide
CID 19191531
2-chloro-N-(1-pyridin-2-ylethyl)propanamide
CID 43523379
phenyl N-[(1S)-1-pyridin-2-ylethyl]carbamate
CID 78980082
(2S)-2-phenoxy-N-[(1S)-1-phenylethyl]propanamide
CID 835918
2-chloro-2-phenyl-N-(1-pyridin-2-ylethyl)acetamide
CID 43523376
2-amino-2-phenyl-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407191
(2S)-2-amino-2-phenyl-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 93096974
(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
CID 7868566
methyl (2R)-2-(4-phenylphenoxy)propanoate
CID 7085245
N-[2-(ethylamino)ethyl]-2-(4-phenylphenoxy)propanamide
CID 119509338
N-[2-[2-(4-phenylphenoxy)propanoylamino]ethyl]benzamide
CID 46686897
(2S)-2-amino-3-methyl-N-[(1R)-1-pyridin-2-ylethyl]pentanamide
CID 81407362

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide?
The IUPAC name of 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide (CID 46408411) is 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide?
The canonical SMILES for 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide is CC(Oc1ccc(-c2ccccc2)cc1)C(=O)NC(C)c1ccccn1.
What is the InChIKey of 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide?
The InChIKey is XMSDMQGVZGESDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2/c1-16(21-10-6-7-15-23-21)24-22(25)17(2)26-20-13-11-19(12-14-20)18-8-4-3-5-9-18/h3-17H,1-2H3,(H,24,25).
What are the key properties of 2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide?
2-(4-phenylphenoxy)-N-(1-pyridin-2-ylethyl)propanamide has a molecular weight of 346.43 g/mol, XLogP of 4.39, 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-(1-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 46408411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).