N-butan-2-yl-2-(4-phenylphenyl)acetamide

C18H21NO — CID 3926947

IUPACN-butan-2-yl-2-(4-phenylphenyl)acetamide
SMILESCCC(C)NC(=O)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H21NO/c1-3-14(2)19-18(20)13-15-9-11-17(12-10-15)16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3,(H,19,20)
InChIKeyWAVIFUQRLJDUAX-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.81
Rot. Bonds5

About N-butan-2-yl-2-(4-phenylphenyl)acetamide

N-butan-2-yl-2-(4-phenylphenyl)acetamide (PubChem CID 3926947) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-butan-2-yl-2-(4-phenylphenyl)acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-(4-phenylphenyl)acetamide
PubChem CID3926947
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-butan-2-yl-2-(4-phenylphenyl)acetamide
SMILESCCC(C)NC(=O)Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H21NO/c1-3-14(2)19-18(20)13-15-9-11-17(12-10-15)16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3,(H,19,20)
InChIKeyWAVIFUQRLJDUAX-UHFFFAOYSA-N
XLogP3.81
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-(4-phenylphenyl)acetamide?
The IUPAC name of N-butan-2-yl-2-(4-phenylphenyl)acetamide (CID 3926947) is N-butan-2-yl-2-(4-phenylphenyl)acetamide.
What is the SMILES notation for N-butan-2-yl-2-(4-phenylphenyl)acetamide?
The canonical SMILES for N-butan-2-yl-2-(4-phenylphenyl)acetamide is CCC(C)NC(=O)Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-butan-2-yl-2-(4-phenylphenyl)acetamide?
The InChIKey is WAVIFUQRLJDUAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-3-14(2)19-18(20)13-15-9-11-17(12-10-15)16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3,(H,19,20).
What are the key properties of N-butan-2-yl-2-(4-phenylphenyl)acetamide?
N-butan-2-yl-2-(4-phenylphenyl)acetamide has a molecular weight of 267.37 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-(4-phenylphenyl)acetamide is sourced from PubChem (CID 3926947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).