3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide

C13H24N2O2 — CID 55164169

IUPAC3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NC(C)C2CCCO2)CCNC1
InChIInChI=1S/C13H24N2O2/c1-3-13(6-7-14-9-13)12(16)15-10(2)11-5-4-8-17-11/h10-11,14H,3-9H2,1-2H3,(H,15,16)
InChIKeyCQFBTADJAWCTOS-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.06
Rot. Bonds4

About 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide

3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide (PubChem CID 55164169) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide
PubChem CID55164169
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NC(C)C2CCCO2)CCNC1
InChIInChI=1S/C13H24N2O2/c1-3-13(6-7-14-9-13)12(16)15-10(2)11-5-4-8-17-11/h10-11,14H,3-9H2,1-2H3,(H,15,16)
InChIKeyCQFBTADJAWCTOS-UHFFFAOYSA-N
XLogP1.06
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-cycloheptylethyl]-3-ethylpyrrolidine-3-carboxamide
CID 81391921
1-(aminomethyl)-N-[1-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119728554
3-methyl-N-[1-(oxolan-2-yl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119944639
N-[(1S)-1-cyclopentylethyl]-4-ethylpiperidine-4-carboxamide
CID 81390475
(2S)-2-[(3-ethylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 63141520
N-(1-amino-3-methyl-1-oxobutan-2-yl)-3-ethylpyrrolidine-3-carboxamide
CID 106345018
N-[(1R)-1-cyclohexylethyl]-4-ethylpiperidine-4-carboxamide
CID 81385512
1-[1-(oxolan-2-yl)ethylcarbamoyl]cyclobutane-1-carboxylic acid
CID 62096067
1-carbamothioyl-N-[1-(oxolan-2-yl)ethyl]cyclopropane-1-carboxamide
CID 80589003
N-(1,3-dihydroxypropan-2-yl)-3-ethylpyrrolidine-3-carboxamide
CID 65314830
3-ethyl-N-(oxan-3-yl)pyrrolidine-3-carboxamide
CID 63361296
3-ethyl-N-hexan-3-ylpyrrolidine-3-carboxamide
CID 63142124

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide (CID 55164169) is 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide is CCC1(C(=O)NC(C)C2CCCO2)CCNC1.
What is the InChIKey of 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide?
The InChIKey is CQFBTADJAWCTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-3-13(6-7-14-9-13)12(16)15-10(2)11-5-4-8-17-11/h10-11,14H,3-9H2,1-2H3,(H,15,16).
What are the key properties of 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide?
3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[1-(oxolan-2-yl)ethyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 55164169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).