N-benzyl-N-methyl-3-phenylpropanamide

C17H19NO — CID 670103

IUPACN-benzyl-N-methyl-3-phenylpropanamide
SMILESCN(Cc1ccccc1)C(=O)CCc1ccccc1
InChIInChI=1S/C17H19NO/c1-18(14-16-10-6-3-7-11-16)17(19)13-12-15-8-4-2-5-9-15/h2-11H,12-14H2,1H3
InChIKeyRPBRKAIJZNHIOD-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.28
Rot. Bonds5

About N-benzyl-N-methyl-3-phenylpropanamide

N-benzyl-N-methyl-3-phenylpropanamide (PubChem CID 670103) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is N-benzyl-N-methyl-3-phenylpropanamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-3-phenylpropanamide
PubChem CID670103
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC NameN-benzyl-N-methyl-3-phenylpropanamide
SMILESCN(Cc1ccccc1)C(=O)CCc1ccccc1
InChIInChI=1S/C17H19NO/c1-18(14-16-10-6-3-7-11-16)17(19)13-12-15-8-4-2-5-9-15/h2-11H,12-14H2,1H3
InChIKeyRPBRKAIJZNHIOD-UHFFFAOYSA-N
XLogP3.28
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-3-phenylpropanamide?
The IUPAC name of N-benzyl-N-methyl-3-phenylpropanamide (CID 670103) is N-benzyl-N-methyl-3-phenylpropanamide.
What is the SMILES notation for N-benzyl-N-methyl-3-phenylpropanamide?
The canonical SMILES for N-benzyl-N-methyl-3-phenylpropanamide is CN(Cc1ccccc1)C(=O)CCc1ccccc1.
What is the InChIKey of N-benzyl-N-methyl-3-phenylpropanamide?
The InChIKey is RPBRKAIJZNHIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-18(14-16-10-6-3-7-11-16)17(19)13-12-15-8-4-2-5-9-15/h2-11H,12-14H2,1H3.
What are the key properties of N-benzyl-N-methyl-3-phenylpropanamide?
N-benzyl-N-methyl-3-phenylpropanamide has a molecular weight of 253.35 g/mol, XLogP of 3.28, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-3-phenylpropanamide is sourced from PubChem (CID 670103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).