2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide

C14H21N3O — CID 83080528

IUPAC2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide
SMILESCCC1(C(=O)NC(C)c2cccnc2)CCCN1
InChIInChI=1S/C14H21N3O/c1-3-14(7-5-9-16-14)13(18)17-11(2)12-6-4-8-15-10-12/h4,6,8,10-11,16H,3,5,7,9H2,1-2H3,(H,17,18)
InChIKeyWGEWMRZCRDSPSN-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.79
Rot. Bonds4

About 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide

2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide (PubChem CID 83080528) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide
PubChem CID83080528
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide
SMILESCCC1(C(=O)NC(C)c2cccnc2)CCCN1
InChIInChI=1S/C14H21N3O/c1-3-14(7-5-9-16-14)13(18)17-11(2)12-6-4-8-15-10-12/h4,6,8,10-11,16H,3,5,7,9H2,1-2H3,(H,17,18)
InChIKeyWGEWMRZCRDSPSN-UHFFFAOYSA-N
XLogP1.79
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-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

2-ethyl-N-[(1S)-1-pyridin-2-ylethyl]pyrrolidine-2-carboxamide
CID 83073993
3-ethyl-N-[(1S)-1-pyridin-3-ylethyl]pyrrolidine-3-carboxamide
CID 81404117
4-propyl-N-(1-pyridin-3-ylethyl)piperidine-4-carboxamide
CID 63127602
1-(aminomethyl)-N-[(1S)-1-pyridin-3-ylethyl]cyclopropane-1-carboxamide
CID 115453576
1-(1-pyridin-3-ylethylcarbamoyl)cyclobutane-1-carboxylic acid
CID 62095230
2-ethyl-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]pyrrolidine-2-carboxamide
CID 83064202
2-ethyl-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]pyrrolidine-2-carboxamide
CID 83071948
N-[1-(2,4-dichlorophenyl)ethyl]-2-ethylpyrrolidine-2-carboxamide
CID 83080607
N-[1-(2,5-difluorophenyl)ethyl]-2-ethylpyrrolidine-2-carboxamide
CID 83072179
1-[2-oxo-2-(1-pyridin-3-ylethylamino)ethyl]cyclohexane-1-carboxylic acid
CID 43529002
1-[2-oxo-2-[[(1R)-1-pyridin-3-ylethyl]amino]ethyl]cyclohexane-1-carboxylic acid
CID 78980760
N-[(1R)-1-pyridin-3-ylethyl]-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 81404390

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide (CID 83080528) is 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide is CCC1(C(=O)NC(C)c2cccnc2)CCCN1.
What is the InChIKey of 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide?
The InChIKey is WGEWMRZCRDSPSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-3-14(7-5-9-16-14)13(18)17-11(2)12-6-4-8-15-10-12/h4,6,8,10-11,16H,3,5,7,9H2,1-2H3,(H,17,18).
What are the key properties of 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide?
2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(1-pyridin-3-ylethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 83080528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).