N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide

C15H22N2O2 — CID 112628516

IUPACN-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
SMILESCC(O)C1CCN(CC(=O)NCc2ccccc2)C1
InChIInChI=1S/C15H22N2O2/c1-12(18)14-7-8-17(10-14)11-15(19)16-9-13-5-3-2-4-6-13/h2-6,12,14,18H,7-11H2,1H3,(H,16,19)
InChIKeyHXVFOSUKXYRUHV-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.01
Rot. Bonds5

About N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide

N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide (PubChem CID 112628516) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
PubChem CID112628516
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
SMILESCC(O)C1CCN(CC(=O)NCc2ccccc2)C1
InChIInChI=1S/C15H22N2O2/c1-12(18)14-7-8-17(10-14)11-15(19)16-9-13-5-3-2-4-6-13/h2-6,12,14,18H,7-11H2,1H3,(H,16,19)
InChIKeyHXVFOSUKXYRUHV-UHFFFAOYSA-N
XLogP1.01
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-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-[[4-(dimethylamino)phenyl]methyl]-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 110020180
N-benzyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
CID 63267740
(1R)-1-[(3S)-1-benzylpyrrolidin-3-yl]ethanol
CID 96766487
N-benzyl-2-[4,7-bis(2-hydroxypropyl)-1,4,7-triazonan-1-yl]acetamide
CID 163526789
N-(furan-2-ylmethyl)-2-[4-(1-hydroxyethyl)piperidin-1-yl]acetamide
CID 103657241
N-benzyl-2-(4-propan-2-ylpiperazin-1-yl)acetamide
CID 30636979
N-benzyl-2-[(3S)-3-methylpiperazin-1-yl]acetamide
CID 104976872
N-[2-(aminomethyl)phenyl]-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 115965021
2-[4-(acetamidomethyl)piperidin-1-yl]-N-benzylacetamide
CID 60510811
ethyl (3S)-1-[2-(benzylamino)-2-oxoethyl]piperidine-3-carboxylate
CID 8532808
2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide
CID 26037570
2-(3-aminoazetidin-1-yl)-N-benzylacetamide
CID 63760913

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide?
The IUPAC name of N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide (CID 112628516) is N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide is CC(O)C1CCN(CC(=O)NCc2ccccc2)C1.
What is the InChIKey of N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide?
The InChIKey is HXVFOSUKXYRUHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12(18)14-7-8-17(10-14)11-15(19)16-9-13-5-3-2-4-6-13/h2-6,12,14,18H,7-11H2,1H3,(H,16,19).
What are the key properties of N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide?
N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 112628516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).