N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide

C16H24N2O — CID 110688197

IUPACN-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide
SMILESCCc1cccc(C)c1NC(=O)CCN1CCCC1
InChIInChI=1S/C16H24N2O/c1-3-14-8-6-7-13(2)16(14)17-15(19)9-12-18-10-4-5-11-18/h6-8H,3-5,9-12H2,1-2H3,(H,17,19)
InChIKeyRTGOSAOBKREZNM-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.98
Rot. Bonds5

About N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide

N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide (PubChem CID 110688197) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide
PubChem CID110688197
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide
SMILESCCc1cccc(C)c1NC(=O)CCN1CCCC1
InChIInChI=1S/C16H24N2O/c1-3-14-8-6-7-13(2)16(14)17-15(19)9-12-18-10-4-5-11-18/h6-8H,3-5,9-12H2,1-2H3,(H,17,19)
InChIKeyRTGOSAOBKREZNM-UHFFFAOYSA-N
XLogP2.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide 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-ethyl-6-methylphenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 109014562
N-(2-ethyl-6-methylphenyl)-4-oxopentanamide
CID 11839711
3-(1,3-dioxoisoindol-2-yl)-N-(2-ethyl-6-methylphenyl)propanamide
CID 723292
N-(2-chloro-6-methylphenyl)-4-pyrrolidin-1-ylbutanamide;hydrochloride
CID 24836116
N-(2-methylphenyl)-3-pyrrolidin-1-ylpropanamide;hydrochloride
CID 2902883
N'-(2-ethyl-6-methylphenyl)butanediamide
CID 82041304
N-(2,6-diethylphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]acetamide
CID 75392697
N-(2-ethyl-6-methylphenyl)tetradecanamide
CID 54789893
3-piperidin-1-yl-N-(2,4,6-trimethylphenyl)propanamide
CID 683819
N-(2,6-diethylphenyl)-3-[4-(4-fluorophenyl)piperazin-1-yl]propanamide
CID 109027339
N-(2-ethyl-6-methylphenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 16554808
5-(2-ethyl-6-methylanilino)-5-oxopentanoate
CID 4740094

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide (CID 110688197) is N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide is CCc1cccc(C)c1NC(=O)CCN1CCCC1.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide?
The InChIKey is RTGOSAOBKREZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-14-8-6-7-13(2)16(14)17-15(19)9-12-18-10-4-5-11-18/h6-8H,3-5,9-12H2,1-2H3,(H,17,19).
What are the key properties of N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide?
N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 110688197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).