N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide

C25H28N2O — CID 9194490

IUPACN-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide
SMILESCN(C)Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H28N2O/c1-27(2)19-21-15-13-20(14-16-21)18-26-25(28)17-24(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-16,24H,17-19H2,1-2H3,(H,26,28)
InChIKeyNIOGKNHXHDXWQA-UHFFFAOYSA-N
MW372.51 g/mol
LogP4.59
Rot. Bonds8

About N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide

N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide (PubChem CID 9194490) has the molecular formula C25H28N2O and a molecular weight of 372.51 g/mol. Its IUPAC name is N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide
PubChem CID9194490
Molecular FormulaC25H28N2O
Molecular Weight372.51 g/mol
Exact Mass372.22
IUPAC NameN-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide
SMILESCN(C)Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H28N2O/c1-27(2)19-21-15-13-20(14-16-21)18-26-25(28)17-24(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-16,24H,17-19H2,1-2H3,(H,26,28)
InChIKeyNIOGKNHXHDXWQA-UHFFFAOYSA-N
XLogP4.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3-phenylbutanamide
CID 78810531
N-[4-[[4-[(dimethylamino)methyl]phenyl]methylamino]-4-oxobutan-2-yl]benzamide
CID 134029595
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-phenoxyacetamide
CID 9194458
N-[2-(dimethylamino)ethyl]-3,3-diphenylpropanamide
CID 2184828
N,N-dimethyl-4-[(3-phenylbutanoylamino)methyl]benzamide
CID 134039082
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 120703369
N-benzyl-3-hydroxy-3-phenylpropanamide
CID 15473661
N-[[4-[(dimethylamino)methyl]phenyl]methyl]pentanamide
CID 78810655
3,3-diphenyl-N-(pyridin-3-ylmethyl)propanamide
CID 690534
3-amino-N-[(4-methylphenyl)methyl]-3-phenylpropanamide
CID 24705411
(3S)-3-acetamido-N-[[4-(dimethylamino)phenyl]methyl]-3-phenylpropanamide
CID 9303942
3,3-diphenyl-N-[(4-thiomorpholin-4-ylphenyl)methyl]propanamide
CID 60521701

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide?
The IUPAC name of N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide (CID 9194490) is N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide.
What is the SMILES notation for N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide?
The canonical SMILES for N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide is CN(C)Cc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide?
The InChIKey is NIOGKNHXHDXWQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O/c1-27(2)19-21-15-13-20(14-16-21)18-26-25(28)17-24(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-16,24H,17-19H2,1-2H3,(H,26,28).
What are the key properties of N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide?
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide has a molecular weight of 372.51 g/mol, XLogP of 4.59, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3,3-diphenylpropanamide is sourced from PubChem (CID 9194490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).