N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide

C22H20ClNO2 — CID 19191556

IUPACN-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide
SMILESCc1cc(Cl)ccc1NC(=O)C(C)Oc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H20ClNO2/c1-15-14-19(23)10-13-21(15)24-22(25)16(2)26-20-11-8-18(9-12-20)17-6-4-3-5-7-17/h3-14,16H,1-2H3,(H,24,25)
InChIKeyGZXZSPOTBGVURN-UHFFFAOYSA-N
MW365.86 g/mol
LogP5.72
Rot. Bonds5

About N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide

N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide (PubChem CID 19191556) has the molecular formula C22H20ClNO2 and a molecular weight of 365.86 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide
PubChem CID19191556
Molecular FormulaC22H20ClNO2
Molecular Weight365.86 g/mol
Exact Mass365.12
IUPAC NameN-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide
SMILESCc1cc(Cl)ccc1NC(=O)C(C)Oc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H20ClNO2/c1-15-14-19(23)10-13-21(15)24-22(25)16(2)26-20-11-8-18(9-12-20)17-6-4-3-5-7-17/h3-14,16H,1-2H3,(H,24,25)
InChIKeyGZXZSPOTBGVURN-UHFFFAOYSA-N
XLogP5.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.86
LogP ≤ 55.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-[2-methyl-4-[3-methyl-4-[[(2S)-2-phenoxypropanoyl]amino]phenyl]phenyl]-2-phenoxypropanamide
CID 2253744
(2R)-2-(4-tert-butylphenoxy)-N-(4-chloro-2-methylphenyl)propanamide
CID 973325
N-(4-chloro-2-methylphenyl)-2-(4-ethoxyphenoxy)propanamide
CID 53267118
N-(4-chloro-2-methylphenyl)-2-(3,5-dimethylphenoxy)propanamide
CID 53266190
(2R)-N-(2-methyl-4-nitrophenyl)-2-(4-phenylphenoxy)propanamide
CID 7231677
(2R)-N-(5-chloro-2-methylphenyl)-2-(4-methylphenoxy)propanamide
CID 837813
N-(4-chloro-2-methylphenyl)-4-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]oxybenzamide
CID 4051387
2-(4-chloro-2-methylphenoxy)-N-(4-chloro-2-methylphenyl)propanamide
CID 2791540
(2R)-N-(4-chloro-2-fluorophenyl)-2-(4-methylphenoxy)propanamide
CID 26529991
N-(2,3-dichlorophenyl)-2-(4-phenylphenoxy)propanamide
CID 4951768
(2R)-N-(2,5-dichlorophenyl)-2-phenoxypropanamide
CID 7723452
N-(2-bromo-4-methylphenyl)-2-(4-phenylphenoxy)propanamide
CID 2969056

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide (CID 19191556) is N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide is Cc1cc(Cl)ccc1NC(=O)C(C)Oc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide?
The InChIKey is GZXZSPOTBGVURN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClNO2/c1-15-14-19(23)10-13-21(15)24-22(25)16(2)26-20-11-8-18(9-12-20)17-6-4-3-5-7-17/h3-14,16H,1-2H3,(H,24,25).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide?
N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide has a molecular weight of 365.86 g/mol, XLogP of 5.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-(4-phenylphenoxy)propanamide is sourced from PubChem (CID 19191556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).