4-phenyl-N-(2-phenylethyl)butanamide

C18H21NO — CID 836348

IUPAC4-phenyl-N-(2-phenylethyl)butanamide
SMILESO=C(CCCc1ccccc1)NCCc1ccccc1
InChIInChI=1S/C18H21NO/c20-18(13-7-12-16-8-3-1-4-9-16)19-15-14-17-10-5-2-6-11-17/h1-6,8-11H,7,12-15H2,(H,19,20)
InChIKeyVSBHSHACXLQYJY-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.37
Rot. Bonds7

About 4-phenyl-N-(2-phenylethyl)butanamide

4-phenyl-N-(2-phenylethyl)butanamide (PubChem CID 836348) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 4-phenyl-N-(2-phenylethyl)butanamide.

Molecular Properties

Compound Name4-phenyl-N-(2-phenylethyl)butanamide
PubChem CID836348
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name4-phenyl-N-(2-phenylethyl)butanamide
SMILESO=C(CCCc1ccccc1)NCCc1ccccc1
InChIInChI=1S/C18H21NO/c20-18(13-7-12-16-8-3-1-4-9-16)19-15-14-17-10-5-2-6-11-17/h1-6,8-11H,7,12-15H2,(H,19,20)
InChIKeyVSBHSHACXLQYJY-UHFFFAOYSA-N
XLogP3.37
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(2-phenylethyl)butanamide?
The IUPAC name of 4-phenyl-N-(2-phenylethyl)butanamide (CID 836348) is 4-phenyl-N-(2-phenylethyl)butanamide.
What is the SMILES notation for 4-phenyl-N-(2-phenylethyl)butanamide?
The canonical SMILES for 4-phenyl-N-(2-phenylethyl)butanamide is O=C(CCCc1ccccc1)NCCc1ccccc1.
What is the InChIKey of 4-phenyl-N-(2-phenylethyl)butanamide?
The InChIKey is VSBHSHACXLQYJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c20-18(13-7-12-16-8-3-1-4-9-16)19-15-14-17-10-5-2-6-11-17/h1-6,8-11H,7,12-15H2,(H,19,20).
What are the key properties of 4-phenyl-N-(2-phenylethyl)butanamide?
4-phenyl-N-(2-phenylethyl)butanamide has a molecular weight of 267.37 g/mol, XLogP of 3.37, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(2-phenylethyl)butanamide is sourced from PubChem (CID 836348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).