(3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide

C12H20N2O2 — CID 9364638

IUPAC(3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide
SMILESCCNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C12H20N2O2/c1-2-13-12(16)9-7-11(15)14(8-9)10-5-3-4-6-10/h9-10H,2-8H2,1H3,(H,13,16)/t9-/m0/s1
InChIKeyHEEJNWFBGZTMSF-VIFPVBQESA-N
MW224.30 g/mol
LogP0.91
Rot. Bonds3

About (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide

(3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide (PubChem CID 9364638) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide
PubChem CID9364638
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name(3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide
SMILESCCNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C12H20N2O2/c1-2-13-12(16)9-7-11(15)14(8-9)10-5-3-4-6-10/h9-10H,2-8H2,1H3,(H,13,16)/t9-/m0/s1
InChIKeyHEEJNWFBGZTMSF-VIFPVBQESA-N
XLogP0.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-N-butyl-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 7030805
N-butyl-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 3236135
1-cyclopentyl-N-(cyclopropylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 47021846
1-cyclohexyl-N-(cyclopentylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 110627517
1-cyclobutyl-N-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 110687444
3-[(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 81369322
1-cyclohexyl-N-(2-methylsulfonylethyl)-5-oxopyrrolidine-3-carboxamide
CID 110612385
N-(3-chloropropyl)-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 17081353
(3S)-1-cyclopentyl-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-5-oxopyrrolidine-3-carboxamide
CID 100909546
(3R)-1-cyclopentyl-N-[(2S)-2-ethylhexyl]-5-oxopyrrolidine-3-carboxamide
CID 9364712
3-[(1-cyclopentyl-5-oxopyrrolidine-3-carbonyl)amino]-2-hydroxypropanoic acid
CID 66167044
N-[2-(cycloheptylamino)ethyl]-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 119619473

Frequently Asked Questions

What is the IUPAC name of (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide (CID 9364638) is (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide is CCNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1.
What is the InChIKey of (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is HEEJNWFBGZTMSF-VIFPVBQESA-N. The full InChI is InChI=1S/C12H20N2O2/c1-2-13-12(16)9-7-11(15)14(8-9)10-5-3-4-6-10/h9-10H,2-8H2,1H3,(H,13,16)/t9-/m0/s1.
What are the key properties of (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide?
(3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 224.30 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-cyclopentyl-N-ethyl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 9364638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).