3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide

C13H24N2O2 — CID 63142216

IUPAC3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NC2(CO)CCCC2)CCNC1
InChIInChI=1S/C13H24N2O2/c1-2-12(7-8-14-9-12)11(17)15-13(10-16)5-3-4-6-13/h14,16H,2-10H2,1H3,(H,15,17)
InChIKeyQLJHTLWHUPCSRY-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.80
Rot. Bonds4

About 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide

3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide (PubChem CID 63142216) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide
PubChem CID63142216
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide
SMILESCCC1(C(=O)NC2(CO)CCCC2)CCNC1
InChIInChI=1S/C13H24N2O2/c1-2-12(7-8-14-9-12)11(17)15-13(10-16)5-3-4-6-13/h14,16H,2-10H2,1H3,(H,15,17)
InChIKeyQLJHTLWHUPCSRY-UHFFFAOYSA-N
XLogP0.80
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(3-ethylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 63141520
3-ethyl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]pyrrolidine-3-carboxamide
CID 107865730
3-ethyl-N-[(1-methylcyclobutyl)methyl]pyrrolidine-3-carboxamide
CID 103826138
N-(1,3-dihydroxypropan-2-yl)-3-ethylpyrrolidine-3-carboxamide
CID 65314830
1-[(3-ethylpiperidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63131743
N-[1-(hydroxymethyl)cyclobutyl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981299
N-tert-butyl-3-ethylpyrrolidine-3-carboxamide
CID 63140815
N-(1-ethylcyclobutyl)-3-fluoropyrrolidine-3-carboxamide;hydrochloride
CID 75513772
1-[(4-ethylpiperidine-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 63128909
3-ethyl-N-(2-ethylsulfinylethyl)pyrrolidine-3-carboxamide
CID 115750111
N-cyclopropyl-3-ethylpyrrolidine-3-carboxamide
CID 63141088
N-(2,2-dimethylbutyl)-3-ethylpyrrolidine-3-carboxamide
CID 103461536

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide (CID 63142216) is 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide is CCC1(C(=O)NC2(CO)CCCC2)CCNC1.
What is the InChIKey of 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide?
The InChIKey is QLJHTLWHUPCSRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-2-12(7-8-14-9-12)11(17)15-13(10-16)5-3-4-6-13/h14,16H,2-10H2,1H3,(H,15,17).
What are the key properties of 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide?
3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.80, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[1-(hydroxymethyl)cyclopentyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 63142216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).