N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide

C23H25N3O — CID 55692566

IUPACN-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
SMILESCN(C)c1ncccc1CNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H25N3O/c1-26(2)23-20(14-9-15-24-23)17-25-22(27)16-21(18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-15,21H,16-17H2,1-2H3,(H,25,27)
InChIKeyFVWCPLHUZCKTPF-UHFFFAOYSA-N
MW359.47 g/mol
LogP3.99
Rot. Bonds7

About N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide

N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide (PubChem CID 55692566) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
PubChem CID55692566
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC NameN-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
SMILESCN(C)c1ncccc1CNC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H25N3O/c1-26(2)23-20(14-9-15-24-23)17-25-22(27)16-21(18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-15,21H,16-17H2,1-2H3,(H,25,27)
InChIKeyFVWCPLHUZCKTPF-UHFFFAOYSA-N
XLogP3.99
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3-phenylpropanamide;dihydrochloride
CID 119953108
3-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]butanamide;dihydrochloride
CID 119850372
2-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylacetamide
CID 119850323
(2R)-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenylbutanamide
CID 51658349
4-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]butanamide
CID 119850383
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-phenoxypropanamide
CID 45243997
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-(1H-indol-3-yl)acetamide
CID 46463836
N-[[2-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]-3,3-diphenylpropanamide
CID 60565634
3-amino-N-[[2-[benzyl(methyl)amino]-3-pyridinyl]methyl]butanamide
CID 56760437
7-amino-N-[[2-(dimethylamino)-3-pyridinyl]methyl]heptanamide
CID 119850321
1-benzyl-3-[[2-(dimethylamino)-3-pyridinyl]methyl]thiourea
CID 43076083
(2R)-N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2-ethoxypropanamide
CID 94775944

Frequently Asked Questions

What is the IUPAC name of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
The IUPAC name of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide (CID 55692566) is N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide.
What is the SMILES notation for N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
The canonical SMILES for N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide is CN(C)c1ncccc1CNC(=O)CC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
The InChIKey is FVWCPLHUZCKTPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c1-26(2)23-20(14-9-15-24-23)17-25-22(27)16-21(18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-15,21H,16-17H2,1-2H3,(H,25,27).
What are the key properties of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide?
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide has a molecular weight of 359.47 g/mol, XLogP of 3.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3,3-diphenylpropanamide is sourced from PubChem (CID 55692566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).