N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide

C14H20N2O — CID 23563457

IUPACN-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide
SMILESCC(=O)N(Cc1ccccc1)C1CCN(C)C1
InChIInChI=1S/C14H20N2O/c1-12(17)16(14-8-9-15(2)11-14)10-13-6-4-3-5-7-13/h3-7,14H,8-11H2,1-2H3
InChIKeyKJFAKRLTZVGAKY-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.74
Rot. Bonds3

About N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide

N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide (PubChem CID 23563457) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide
PubChem CID23563457
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide
SMILESCC(=O)N(Cc1ccccc1)C1CCN(C)C1
InChIInChI=1S/C14H20N2O/c1-12(17)16(14-8-9-15(2)11-14)10-13-6-4-3-5-7-13/h3-7,14H,8-11H2,1-2H3
InChIKeyKJFAKRLTZVGAKY-UHFFFAOYSA-N
XLogP1.74
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide 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-benzyl-N-(1-methylpyrrolidin-3-yl)formamide;propane
CID 142016976
ethane;N-ethyl-N-(1-methylpyrrolidin-3-yl)acetamide
CID 143734601
N,N-dibenzyl-2-(1-methylpiperidin-4-yl)acetamide
CID 99969717
N-benzyl-N,1-dimethylpiperidin-3-amine;ethane
CID 142272680
4-[[acetyl(cyclopentyl)amino]methyl]benzoic acid
CID 20982029
N-[(2S,3S)-1-acetyl-2-formylpyrrolidin-3-yl]-N-benzylacetamide
CID 11000713
N'-benzyl-N'-(1-methylpyrrolidin-3-yl)propane-1,3-diamine
CID 107365088
N-(1-methylpiperidin-4-yl)-N-phenylacetamide
CID 527022
1-benzyl-1-cyclopropyl-3-ethylurea
CID 127578302
N-benzyl-2-(1-methylpiperidin-4-yl)-N-phenylacetamide
CID 110754688
3-[acetyl(benzyl)amino]-N-[(3S)-1-methylpiperidin-3-yl]propanamide
CID 96523044
benzyl(piperidin-4-yl)carbamic acid
CID 54298382

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide?
The IUPAC name of N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide (CID 23563457) is N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide.
What is the SMILES notation for N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide?
The canonical SMILES for N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide is CC(=O)N(Cc1ccccc1)C1CCN(C)C1.
What is the InChIKey of N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide?
The InChIKey is KJFAKRLTZVGAKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-12(17)16(14-8-9-15(2)11-14)10-13-6-4-3-5-7-13/h3-7,14H,8-11H2,1-2H3.
What are the key properties of N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide?
N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide has a molecular weight of 232.33 g/mol, XLogP of 1.74, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(1-methylpyrrolidin-3-yl)acetamide is sourced from PubChem (CID 23563457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).