N-methyl-4,4-diphenylbutanamide

C17H19NO — CID 125470248

IUPACN-methyl-4,4-diphenylbutanamide
SMILESCNC(=O)CCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-18-17(19)13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3,(H,18,19)
InChIKeyRNJUMMQLGNVBNX-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.34
Rot. Bonds5

About N-methyl-4,4-diphenylbutanamide

N-methyl-4,4-diphenylbutanamide (PubChem CID 125470248) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is N-methyl-4,4-diphenylbutanamide.

Molecular Properties

Compound NameN-methyl-4,4-diphenylbutanamide
PubChem CID125470248
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC NameN-methyl-4,4-diphenylbutanamide
SMILESCNC(=O)CCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NO/c1-18-17(19)13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3,(H,18,19)
InChIKeyRNJUMMQLGNVBNX-UHFFFAOYSA-N
XLogP3.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-3,3-diphenylpropanamide
CID 3373592
3-(2,2-diphenylethylamino)-N-methylpropanamide
CID 103896928
[4-(methylamino)-4-oxo-1-phenylbutyl] acetate
CID 71678078
tert-butyl N-[(1R)-4-(methylamino)-4-oxo-1-phenylbutyl]carbamate
CID 95338638
tert-butyl N-[(1S)-4-(methylamino)-4-oxo-1-phenylbutyl]carbamate
CID 95338637
methyl 2-oxo-5,5-diphenylpentanoate
CID 18371006
2-(2,2-diphenylethylamino)-N-methylpropanamide
CID 103603774
4-(3-aminophenyl)-4-hydroxy-N-methylbutanamide
CID 82113079
4-(2-aminophenyl)-N-methylpentanamide
CID 143020696
(2S)-2-[[3-(methylamino)-3-oxopropyl]carbamoylamino]-2-phenylacetic acid
CID 103999864
(3R)-N-(3,3-diphenylpropyl)-3-phenylbutanamide
CID 40629946
N-(3,3-diphenylpropyl)-2-(methylamino)acetamide;hydrochloride
CID 119675915

Frequently Asked Questions

What is the IUPAC name of N-methyl-4,4-diphenylbutanamide?
The IUPAC name of N-methyl-4,4-diphenylbutanamide (CID 125470248) is N-methyl-4,4-diphenylbutanamide.
What is the SMILES notation for N-methyl-4,4-diphenylbutanamide?
The canonical SMILES for N-methyl-4,4-diphenylbutanamide is CNC(=O)CCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-methyl-4,4-diphenylbutanamide?
The InChIKey is RNJUMMQLGNVBNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-18-17(19)13-12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3,(H,18,19).
What are the key properties of N-methyl-4,4-diphenylbutanamide?
N-methyl-4,4-diphenylbutanamide has a molecular weight of 253.35 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4,4-diphenylbutanamide is sourced from PubChem (CID 125470248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).