2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide

C18H20ClNO — CID 17327434

IUPAC2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide
SMILESCc1ccc(C)c(C(C)NC(=O)Cc2ccccc2Cl)c1
InChIInChI=1S/C18H20ClNO/c1-12-8-9-13(2)16(10-12)14(3)20-18(21)11-15-6-4-5-7-17(15)19/h4-10,14H,11H2,1-3H3,(H,20,21)
InChIKeyFRKAFDNATNMHHD-UHFFFAOYSA-N
MW301.82 g/mol
LogP4.38
Rot. Bonds4

About 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide

2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide (PubChem CID 17327434) has the molecular formula C18H20ClNO and a molecular weight of 301.82 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide
PubChem CID17327434
Molecular FormulaC18H20ClNO
Molecular Weight301.82 g/mol
Exact Mass301.12
IUPAC Name2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide
SMILESCc1ccc(C)c(C(C)NC(=O)Cc2ccccc2Cl)c1
InChIInChI=1S/C18H20ClNO/c1-12-8-9-13(2)16(10-12)14(3)20-18(21)11-15-6-4-5-7-17(15)19/h4-10,14H,11H2,1-3H3,(H,20,21)
InChIKeyFRKAFDNATNMHHD-UHFFFAOYSA-N
XLogP4.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2-chlorophenyl)methylsulfanyl]-N-[1-(2,5-dimethylphenyl)ethyl]acetamide
CID 132652858
3-(2,6-dichlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]propanamide
CID 133225019
N-[1-(2-bromophenyl)ethyl]-2-(2-chlorophenyl)acetamide
CID 42998474
3-chloro-N-[1-(2,5-dimethylphenyl)ethyl]propanamide
CID 17327223
(2R)-2-(2-chlorophenoxy)-N-[(1R)-1-(2,5-dimethylphenyl)ethyl]propanamide
CID 94843604
2-(4-bromophenyl)-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]acetamide
CID 841018
2-(2-chloro-N-methylsulfonylanilino)-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]acetamide
CID 30219526
N-[1-(2,5-dimethylphenyl)ethyl]-3-phenylpropanamide
CID 17327195
N-[1-(2,5-dimethylphenyl)ethyl]-2-(3-methoxyphenyl)acetamide
CID 43009880
N-[1-(2,5-dimethylphenyl)ethyl]-2-[(2-fluorophenyl)methylsulfanyl]acetamide
CID 132651519
(2R)-N-[(1R)-1-(2,5-dimethylphenyl)ethyl]-2-phenoxybutanamide
CID 26171764
1-[(2-chlorophenyl)methylsulfonyl]-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]piperidine-4-carboxamide
CID 99131182

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide (CID 17327434) is 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide is Cc1ccc(C)c(C(C)NC(=O)Cc2ccccc2Cl)c1.
What is the InChIKey of 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide?
The InChIKey is FRKAFDNATNMHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO/c1-12-8-9-13(2)16(10-12)14(3)20-18(21)11-15-6-4-5-7-17(15)19/h4-10,14H,11H2,1-3H3,(H,20,21).
What are the key properties of 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide?
2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide has a molecular weight of 301.82 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[1-(2,5-dimethylphenyl)ethyl]acetamide is sourced from PubChem (CID 17327434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).