N-benzyl-3-phenyl-N-propan-2-ylpropanamide

C19H23NO — CID 875288

IUPACN-benzyl-3-phenyl-N-propan-2-ylpropanamide
SMILESCC(C)N(Cc1ccccc1)C(=O)CCc1ccccc1
InChIInChI=1S/C19H23NO/c1-16(2)20(15-18-11-7-4-8-12-18)19(21)14-13-17-9-5-3-6-10-17/h3-12,16H,13-15H2,1-2H3
InChIKeyMGNMFXYCTMKDGZ-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.06
Rot. Bonds6

About N-benzyl-3-phenyl-N-propan-2-ylpropanamide

N-benzyl-3-phenyl-N-propan-2-ylpropanamide (PubChem CID 875288) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-benzyl-3-phenyl-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-benzyl-3-phenyl-N-propan-2-ylpropanamide
PubChem CID875288
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-benzyl-3-phenyl-N-propan-2-ylpropanamide
SMILESCC(C)N(Cc1ccccc1)C(=O)CCc1ccccc1
InChIInChI=1S/C19H23NO/c1-16(2)20(15-18-11-7-4-8-12-18)19(21)14-13-17-9-5-3-6-10-17/h3-12,16H,13-15H2,1-2H3
InChIKeyMGNMFXYCTMKDGZ-UHFFFAOYSA-N
XLogP4.06
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-phenyl-N-propan-2-ylpropanamide?
The IUPAC name of N-benzyl-3-phenyl-N-propan-2-ylpropanamide (CID 875288) is N-benzyl-3-phenyl-N-propan-2-ylpropanamide.
What is the SMILES notation for N-benzyl-3-phenyl-N-propan-2-ylpropanamide?
The canonical SMILES for N-benzyl-3-phenyl-N-propan-2-ylpropanamide is CC(C)N(Cc1ccccc1)C(=O)CCc1ccccc1.
What is the InChIKey of N-benzyl-3-phenyl-N-propan-2-ylpropanamide?
The InChIKey is MGNMFXYCTMKDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-16(2)20(15-18-11-7-4-8-12-18)19(21)14-13-17-9-5-3-6-10-17/h3-12,16H,13-15H2,1-2H3.
What are the key properties of N-benzyl-3-phenyl-N-propan-2-ylpropanamide?
N-benzyl-3-phenyl-N-propan-2-ylpropanamide has a molecular weight of 281.40 g/mol, XLogP of 4.06, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-phenyl-N-propan-2-ylpropanamide is sourced from PubChem (CID 875288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).