2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide

C18H20ClNO — CID 93236026

IUPAC2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
SMILESCCc1ccc([C@@H](C)NC(=O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C18H20ClNO/c1-3-14-4-8-16(9-5-14)13(2)20-18(21)12-15-6-10-17(19)11-7-15/h4-11,13H,3,12H2,1-2H3,(H,20,21)/t13-/m1/s1
InChIKeyPKQPNGYRAKHQDB-CYBMUJFWSA-N
MW301.82 g/mol
LogP4.32
Rot. Bonds5

About 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide

2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide (PubChem CID 93236026) has the molecular formula C18H20ClNO and a molecular weight of 301.82 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
PubChem CID93236026
Molecular FormulaC18H20ClNO
Molecular Weight301.82 g/mol
Exact Mass301.12
IUPAC Name2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
SMILESCCc1ccc([C@@H](C)NC(=O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C18H20ClNO/c1-3-14-4-8-16(9-5-14)13(2)20-18(21)12-15-6-10-17(19)11-7-15/h4-11,13H,3,12H2,1-2H3,(H,20,21)/t13-/m1/s1
InChIKeyPKQPNGYRAKHQDB-CYBMUJFWSA-N
XLogP4.32
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide (CID 93236026) is 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide is CCc1ccc([C@@H](C)NC(=O)Cc2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide?
The InChIKey is PKQPNGYRAKHQDB-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H20ClNO/c1-3-14-4-8-16(9-5-14)13(2)20-18(21)12-15-6-10-17(19)11-7-15/h4-11,13H,3,12H2,1-2H3,(H,20,21)/t13-/m1/s1.
What are the key properties of 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide?
2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide has a molecular weight of 301.82 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide is sourced from PubChem (CID 93236026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).