2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide

C18H20ClNO2 — CID 133166961

IUPAC2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
SMILESCc1ccc(OCC(C)NC(=O)Cc2ccccc2Cl)cc1
InChIInChI=1S/C18H20ClNO2/c1-13-7-9-16(10-8-13)22-12-14(2)20-18(21)11-15-5-3-4-6-17(15)19/h3-10,14H,11-12H2,1-2H3,(H,20,21)
InChIKeyFYUDGMGQFSDVAH-UHFFFAOYSA-N
MW317.82 g/mol
LogP3.77
Rot. Bonds6

About 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide

2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide (PubChem CID 133166961) has the molecular formula C18H20ClNO2 and a molecular weight of 317.82 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
PubChem CID133166961
Molecular FormulaC18H20ClNO2
Molecular Weight317.82 g/mol
Exact Mass317.12
IUPAC Name2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
SMILESCc1ccc(OCC(C)NC(=O)Cc2ccccc2Cl)cc1
InChIInChI=1S/C18H20ClNO2/c1-13-7-9-16(10-8-13)22-12-14(2)20-18(21)11-15-5-3-4-6-17(15)19/h3-10,14H,11-12H2,1-2H3,(H,20,21)
InChIKeyFYUDGMGQFSDVAH-UHFFFAOYSA-N
XLogP3.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.82
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-N-[(2S)-1-(4-methoxyphenoxy)propan-2-yl]acetamide
CID 100630978
2-(2-chlorophenyl)-N-[1-(2-methylphenoxy)propan-2-yl]acetamide
CID 133166960
2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
CID 132650444
N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 92680005
3-[[2-(2-chlorophenyl)acetyl]amino]butanoic acid
CID 43240713
2-[N-(benzenesulfonyl)-2,3-dichloroanilino]-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
CID 43893493
N-[1-(4-methylphenoxy)propan-2-yl]-2-thiophen-2-ylacetamide
CID 47450824
N-[(2S)-1-(4-methylphenoxy)propan-2-yl]-2-phenylsulfanylacetamide
CID 99998889
N-[1-(4-methylphenoxy)propan-2-yl]-2-naphthalen-2-yloxyacetamide
CID 132652959
N-[1-(4-methylphenoxy)propan-2-yl]-2-phenoxybutanamide
CID 132651239
3-(3,4-dichlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]propanamide
CID 133220730
4-hydroxy-N-[1-(4-methylphenoxy)propan-2-yl]butanamide
CID 79192194

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide (CID 133166961) is 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide is Cc1ccc(OCC(C)NC(=O)Cc2ccccc2Cl)cc1.
What is the InChIKey of 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
The InChIKey is FYUDGMGQFSDVAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO2/c1-13-7-9-16(10-8-13)22-12-14(2)20-18(21)11-15-5-3-4-6-17(15)19/h3-10,14H,11-12H2,1-2H3,(H,20,21).
What are the key properties of 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide has a molecular weight of 317.82 g/mol, XLogP of 3.77, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide is sourced from PubChem (CID 133166961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).