3-phenyl-N-(1-phenylbutan-2-yl)propanamide

C19H23NO — CID 2975156

IUPAC3-phenyl-N-(1-phenylbutan-2-yl)propanamide
SMILESCCC(Cc1ccccc1)NC(=O)CCc1ccccc1
InChIInChI=1S/C19H23NO/c1-2-18(15-17-11-7-4-8-12-17)20-19(21)14-13-16-9-5-3-6-10-16/h3-12,18H,2,13-15H2,1H3,(H,20,21)
InChIKeyHUECLCCOILERFD-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.76
Rot. Bonds7

About 3-phenyl-N-(1-phenylbutan-2-yl)propanamide

3-phenyl-N-(1-phenylbutan-2-yl)propanamide (PubChem CID 2975156) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 3-phenyl-N-(1-phenylbutan-2-yl)propanamide.

Molecular Properties

Compound Name3-phenyl-N-(1-phenylbutan-2-yl)propanamide
PubChem CID2975156
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name3-phenyl-N-(1-phenylbutan-2-yl)propanamide
SMILESCCC(Cc1ccccc1)NC(=O)CCc1ccccc1
InChIInChI=1S/C19H23NO/c1-2-18(15-17-11-7-4-8-12-17)20-19(21)14-13-16-9-5-3-6-10-16/h3-12,18H,2,13-15H2,1H3,(H,20,21)
InChIKeyHUECLCCOILERFD-UHFFFAOYSA-N
XLogP3.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-(1-phenylbutan-2-yl)propanamide?
The IUPAC name of 3-phenyl-N-(1-phenylbutan-2-yl)propanamide (CID 2975156) is 3-phenyl-N-(1-phenylbutan-2-yl)propanamide.
What is the SMILES notation for 3-phenyl-N-(1-phenylbutan-2-yl)propanamide?
The canonical SMILES for 3-phenyl-N-(1-phenylbutan-2-yl)propanamide is CCC(Cc1ccccc1)NC(=O)CCc1ccccc1.
What is the InChIKey of 3-phenyl-N-(1-phenylbutan-2-yl)propanamide?
The InChIKey is HUECLCCOILERFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-18(15-17-11-7-4-8-12-17)20-19(21)14-13-16-9-5-3-6-10-16/h3-12,18H,2,13-15H2,1H3,(H,20,21).
What are the key properties of 3-phenyl-N-(1-phenylbutan-2-yl)propanamide?
3-phenyl-N-(1-phenylbutan-2-yl)propanamide has a molecular weight of 281.40 g/mol, XLogP of 3.76, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-(1-phenylbutan-2-yl)propanamide is sourced from PubChem (CID 2975156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).