N-benzhydryl-2-methylpropanamide

C17H19NO — CID 871906

IUPACN-benzhydryl-2-methylpropanamide
SMILESCC(C)C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-13(2)17(19)18-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16H,1-2H3,(H,18,19)
InChIKeyZDHMLHRXLMDODX-UHFFFAOYSA-N
MW253.34 g/mol
LogP3.55
Rot. Bonds4

About N-benzhydryl-2-methylpropanamide

N-benzhydryl-2-methylpropanamide (PubChem CID 871906) has the molecular formula C17H19NO and a molecular weight of 253.34 g/mol. Its IUPAC name is N-benzhydryl-2-methylpropanamide.

Molecular Properties

Compound NameN-benzhydryl-2-methylpropanamide
PubChem CID871906
Molecular FormulaC17H19NO
Molecular Weight253.34 g/mol
Exact Mass253.15
IUPAC NameN-benzhydryl-2-methylpropanamide
SMILESCC(C)C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-13(2)17(19)18-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16H,1-2H3,(H,18,19)
InChIKeyZDHMLHRXLMDODX-UHFFFAOYSA-N
XLogP3.55
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-methylpropanamide?
The IUPAC name of N-benzhydryl-2-methylpropanamide (CID 871906) is N-benzhydryl-2-methylpropanamide.
What is the SMILES notation for N-benzhydryl-2-methylpropanamide?
The canonical SMILES for N-benzhydryl-2-methylpropanamide is CC(C)C(=O)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydryl-2-methylpropanamide?
The InChIKey is ZDHMLHRXLMDODX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-13(2)17(19)18-16(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16H,1-2H3,(H,18,19).
What are the key properties of N-benzhydryl-2-methylpropanamide?
N-benzhydryl-2-methylpropanamide has a molecular weight of 253.34 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-methylpropanamide is sourced from PubChem (CID 871906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).