5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide

C12H21N3O2 — CID 62034686

IUPAC5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide
SMILESCC(NC(=O)C1CCC(=O)N1)C1CCCNC1
InChIInChI=1S/C12H21N3O2/c1-8(9-3-2-6-13-7-9)14-12(17)10-4-5-11(16)15-10/h8-10,13H,2-7H2,1H3,(H,14,17)(H,15,16)
InChIKeyZMSIESQJGRNKIE-UHFFFAOYSA-N
MW239.32 g/mol
LogP-0.23
Rot. Bonds3

About 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide

5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide (PubChem CID 62034686) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide
PubChem CID62034686
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide
SMILESCC(NC(=O)C1CCC(=O)N1)C1CCCNC1
InChIInChI=1S/C12H21N3O2/c1-8(9-3-2-6-13-7-9)14-12(17)10-4-5-11(16)15-10/h8-10,13H,2-7H2,1H3,(H,14,17)(H,15,16)
InChIKeyZMSIESQJGRNKIE-UHFFFAOYSA-N
XLogP-0.23
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-piperidin-3-ylethyl)cyclopentanecarboxamide
CID 43523140
(2S)-5-oxo-N-propan-2-ylpyrrolidine-2-carboxamide
CID 11105798
(2R)-5-oxo-N-piperidin-3-ylpyrrolidine-2-carboxamide
CID 103805383
2-amino-N-(1-piperidin-3-ylethyl)propanamide
CID 131134166
(2R)-2-amino-N-(1-piperidin-3-ylethyl)propanamide
CID 131038230
1-(1-piperidin-3-ylethyl)-3-propan-2-ylurea
CID 43523388
N-(1-piperidin-3-ylethyl)oxolane-2-carboxamide;hydrochloride
CID 119260228
N-(1-piperidin-3-ylethyl)-2,3-dihydro-1-benzofuran-2-carboxamide;hydrochloride
CID 119474149
N-(1-piperidin-3-ylethyl)piperidine-1-carboxamide
CID 79155447
(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide
CID 93216020
N-(1-piperidin-3-ylethyl)tricyclo[3.2.1.02,4]octane-3-carboxamide;hydrochloride
CID 119474123
1-methyl-N-(1-piperidin-3-ylethyl)pyrrolidine-3-carboxamide
CID 62034340

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide (CID 62034686) is 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide is CC(NC(=O)C1CCC(=O)N1)C1CCCNC1.
What is the InChIKey of 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide?
The InChIKey is ZMSIESQJGRNKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-8(9-3-2-6-13-7-9)14-12(17)10-4-5-11(16)15-10/h8-10,13H,2-7H2,1H3,(H,14,17)(H,15,16).
What are the key properties of 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide?
5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide has a molecular weight of 239.32 g/mol, XLogP of -0.23, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 62034686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).