N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide

C17H27N3O — CID 119885733

IUPACN-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide
SMILESCC(CNC(=O)CC1CCCN1)N(C)Cc1ccccc1
InChIInChI=1S/C17H27N3O/c1-14(20(2)13-15-7-4-3-5-8-15)12-19-17(21)11-16-9-6-10-18-16/h3-5,7-8,14,16,18H,6,9-13H2,1-2H3,(H,19,21)
InChIKeyIABIBRSRHUCPRW-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.77
Rot. Bonds7

About N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide

N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 119885733) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide
PubChem CID119885733
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide
SMILESCC(CNC(=O)CC1CCCN1)N(C)Cc1ccccc1
InChIInChI=1S/C17H27N3O/c1-14(20(2)13-15-7-4-3-5-8-15)12-19-17(21)11-16-9-6-10-18-16/h3-5,7-8,14,16,18H,6,9-13H2,1-2H3,(H,19,21)
InChIKeyIABIBRSRHUCPRW-UHFFFAOYSA-N
XLogP1.77
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)-2-phenylethyl]-2-pyrrolidin-2-ylacetamide
CID 61365271
N-(2-methyl-3-phenylmethoxypropyl)-2-pyrrolidin-2-ylacetamide
CID 119750679
N-(2-phenylsulfanylpropyl)-2-pyrrolidin-2-ylacetamide
CID 119804444
N-(2,3-diphenylpropyl)-2-pyrrolidin-2-ylacetamide
CID 119803974
N-(2-phenoxypropyl)-2-pyrrolidin-2-ylacetamide
CID 119734660
N-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119845632
N-[2-[benzyl(methyl)amino]propyl]-2-sulfanylacetamide
CID 131141172
(2S,4S)-N-[2-[benzyl(methyl)amino]propyl]-2-methylpiperidine-4-carboxamide
CID 120636391
2-methyl-3-[(2-pyrrolidin-2-ylacetyl)amino]propanoic acid
CID 62669553
N-[[3-[[ethyl(methyl)amino]methyl]phenyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119862577
N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2-pyrrolidin-2-ylacetamide
CID 119859537
N-[2-(4-phenylpiperazin-1-yl)propyl]-2-pyrrolidin-2-ylacetamide
CID 119902110

Frequently Asked Questions

What is the IUPAC name of N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide (CID 119885733) is N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide is CC(CNC(=O)CC1CCCN1)N(C)Cc1ccccc1.
What is the InChIKey of N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is IABIBRSRHUCPRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-14(20(2)13-15-7-4-3-5-8-15)12-19-17(21)11-16-9-6-10-18-16/h3-5,7-8,14,16,18H,6,9-13H2,1-2H3,(H,19,21).
What are the key properties of N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide?
N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 289.42 g/mol, XLogP of 1.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[benzyl(methyl)amino]propyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 119885733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).