N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide

C16H22N2O2 — CID 47127072

IUPACN-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide
SMILESCCOc1ccc(C2CCCN2C(=O)NC2CC2)cc1
InChIInChI=1S/C16H22N2O2/c1-2-20-14-9-5-12(6-10-14)15-4-3-11-18(15)16(19)17-13-7-8-13/h5-6,9-10,13,15H,2-4,7-8,11H2,1H3,(H,17,19)
InChIKeyJYSUKMZQJOPJBD-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.09
Rot. Bonds4

About N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide

N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide (PubChem CID 47127072) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide
PubChem CID47127072
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide
SMILESCCOc1ccc(C2CCCN2C(=O)NC2CC2)cc1
InChIInChI=1S/C16H22N2O2/c1-2-20-14-9-5-12(6-10-14)15-4-3-11-18(15)16(19)17-13-7-8-13/h5-6,9-10,13,15H,2-4,7-8,11H2,1H3,(H,17,19)
InChIKeyJYSUKMZQJOPJBD-UHFFFAOYSA-N
XLogP3.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide 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

(2S)-N-(4-ethoxyphenyl)-2-(4-methylphenyl)pyrrolidine-1-carboxamide
CID 51855939
1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]butan-1-one
CID 134017853
N-(2-bromophenyl)-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide
CID 86986350
2-(4-ethoxyphenyl)-N-(4-methylsulfonylphenyl)pyrrolidine-1-carboxamide
CID 86987525
N-(4-ethoxyphenyl)-2-(4-methylphenyl)azepane-1-carboxamide
CID 53096328
2-(4-ethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyrrolidine-1-carboxamide
CID 86914008
N-(2,4-difluorophenyl)-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide
CID 51223443
2-(4-ethoxyphenyl)-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]pyrrolidine-1-carboxamide
CID 60577976
(2S)-2-(4-ethoxyphenyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide
CID 94048522
1-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]-2-[4-(hydroxymethyl)piperidin-1-yl]ethanone
CID 110899355
(2S)-2-(4-ethoxyphenyl)-N-(3-pyrazol-1-ylpropyl)pyrrolidine-1-carboxamide
CID 94030721
1-[(2S)-2-(4-chlorophenyl)pyrrolidin-1-yl]-2-(4-ethoxyphenyl)ethanone
CID 94080642

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide (CID 47127072) is N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide is CCOc1ccc(C2CCCN2C(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide?
The InChIKey is JYSUKMZQJOPJBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-2-20-14-9-5-12(6-10-14)15-4-3-11-18(15)16(19)17-13-7-8-13/h5-6,9-10,13,15H,2-4,7-8,11H2,1H3,(H,17,19).
What are the key properties of N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide?
N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide has a molecular weight of 274.36 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(4-ethoxyphenyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 47127072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).