2-phenyl-N-(4-propan-2-ylphenyl)butanamide

C19H23NO — CID 3145065

IUPAC2-phenyl-N-(4-propan-2-ylphenyl)butanamide
SMILESCCC(C(=O)Nc1ccc(C(C)C)cc1)c1ccccc1
InChIInChI=1S/C19H23NO/c1-4-18(16-8-6-5-7-9-16)19(21)20-17-12-10-15(11-13-17)14(2)3/h5-14,18H,4H2,1-3H3,(H,20,21)
InChIKeyZXBNGZTYJNVTQS-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.94
Rot. Bonds5

About 2-phenyl-N-(4-propan-2-ylphenyl)butanamide

2-phenyl-N-(4-propan-2-ylphenyl)butanamide (PubChem CID 3145065) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-phenyl-N-(4-propan-2-ylphenyl)butanamide.

Molecular Properties

Compound Name2-phenyl-N-(4-propan-2-ylphenyl)butanamide
PubChem CID3145065
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name2-phenyl-N-(4-propan-2-ylphenyl)butanamide
SMILESCCC(C(=O)Nc1ccc(C(C)C)cc1)c1ccccc1
InChIInChI=1S/C19H23NO/c1-4-18(16-8-6-5-7-9-16)19(21)20-17-12-10-15(11-13-17)14(2)3/h5-14,18H,4H2,1-3H3,(H,20,21)
InChIKeyZXBNGZTYJNVTQS-UHFFFAOYSA-N
XLogP4.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(4-propan-2-ylphenyl)butanamide?
The IUPAC name of 2-phenyl-N-(4-propan-2-ylphenyl)butanamide (CID 3145065) is 2-phenyl-N-(4-propan-2-ylphenyl)butanamide.
What is the SMILES notation for 2-phenyl-N-(4-propan-2-ylphenyl)butanamide?
The canonical SMILES for 2-phenyl-N-(4-propan-2-ylphenyl)butanamide is CCC(C(=O)Nc1ccc(C(C)C)cc1)c1ccccc1.
What is the InChIKey of 2-phenyl-N-(4-propan-2-ylphenyl)butanamide?
The InChIKey is ZXBNGZTYJNVTQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-4-18(16-8-6-5-7-9-16)19(21)20-17-12-10-15(11-13-17)14(2)3/h5-14,18H,4H2,1-3H3,(H,20,21).
What are the key properties of 2-phenyl-N-(4-propan-2-ylphenyl)butanamide?
2-phenyl-N-(4-propan-2-ylphenyl)butanamide has a molecular weight of 281.40 g/mol, XLogP of 4.94, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(4-propan-2-ylphenyl)butanamide is sourced from PubChem (CID 3145065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).