2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide

C19H23NO — CID 2937998

IUPAC2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide
SMILESCc1ccc(CC(=O)NC(C)CCc2ccccc2)cc1
InChIInChI=1S/C19H23NO/c1-15-8-11-18(12-9-15)14-19(21)20-16(2)10-13-17-6-4-3-5-7-17/h3-9,11-12,16H,10,13-14H2,1-2H3,(H,20,21)
InChIKeyNMBOYSMGGUZSCD-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.68
Rot. Bonds6

About 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide

2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide (PubChem CID 2937998) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide
PubChem CID2937998
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide
SMILESCc1ccc(CC(=O)NC(C)CCc2ccccc2)cc1
InChIInChI=1S/C19H23NO/c1-15-8-11-18(12-9-15)14-19(21)20-16(2)10-13-17-6-4-3-5-7-17/h3-9,11-12,16H,10,13-14H2,1-2H3,(H,20,21)
InChIKeyNMBOYSMGGUZSCD-UHFFFAOYSA-N
XLogP3.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide (CID 2937998) is 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide is Cc1ccc(CC(=O)NC(C)CCc2ccccc2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide?
The InChIKey is NMBOYSMGGUZSCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-15-8-11-18(12-9-15)14-19(21)20-16(2)10-13-17-6-4-3-5-7-17/h3-9,11-12,16H,10,13-14H2,1-2H3,(H,20,21).
What are the key properties of 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide?
2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide has a molecular weight of 281.40 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-(4-phenylbutan-2-yl)acetamide is sourced from PubChem (CID 2937998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).