N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide

C15H22N2O — CID 95774756

IUPACN-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide
SMILESCCc1ccc(NC(=O)CN2CCC[C@@H]2C)cc1
InChIInChI=1S/C15H22N2O/c1-3-13-6-8-14(9-7-13)16-15(18)11-17-10-4-5-12(17)2/h6-9,12H,3-5,10-11H2,1-2H3,(H,16,18)/t12-/m0/s1
InChIKeySFCYARFLJWIGOO-LBPRGKRZSA-N
MW246.35 g/mol
LogP2.67
Rot. Bonds4

About N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide

N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide (PubChem CID 95774756) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide
PubChem CID95774756
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide
SMILESCCc1ccc(NC(=O)CN2CCC[C@@H]2C)cc1
InChIInChI=1S/C15H22N2O/c1-3-13-6-8-14(9-7-13)16-15(18)11-17-10-4-5-12(17)2/h6-9,12H,3-5,10-11H2,1-2H3,(H,16,18)/t12-/m0/s1
InChIKeySFCYARFLJWIGOO-LBPRGKRZSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-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-acetamidophenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 4818604
N-(4-iodophenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 2697962
N-(4-bromophenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 2655150
N-(4-tert-butylphenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 18078471
N-(4-ethoxyphenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 8583349
2-[(2S)-2-methylpiperidin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 8583231
2-[(2S)-2-methylpiperidin-1-yl]-N-(4-nitrophenyl)acetamide
CID 8583375
N-[4-(aminomethyl)phenyl]-3-(2-methylpyrrolidin-1-yl)propanamide
CID 54882030
N-(3,4-dichlorophenyl)-2-[(2S)-2-methylpiperidin-1-yl]acetamide
CID 2697918
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(2-methylpiperidin-1-yl)acetamide
CID 55409696
N-[4-(difluoromethoxy)phenyl]-2-(2-methylpiperidin-1-yl)acetamide
CID 4818615
2-(4-ethyl-2,3-dioxopiperazin-1-yl)-N-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]acetamide
CID 55972021

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide?
The IUPAC name of N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide (CID 95774756) is N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide is CCc1ccc(NC(=O)CN2CCC[C@@H]2C)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide?
The InChIKey is SFCYARFLJWIGOO-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-13-6-8-14(9-7-13)16-15(18)11-17-10-4-5-12(17)2/h6-9,12H,3-5,10-11H2,1-2H3,(H,16,18)/t12-/m0/s1.
What are the key properties of N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide?
N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide has a molecular weight of 246.35 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide is sourced from PubChem (CID 95774756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).