(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide

C9H15N3O2 — CID 93216020

IUPAC(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide
SMILESO=C1CC[C@@H](C(=O)N[C@H]2CCNC2)N1
InChIInChI=1S/C9H15N3O2/c13-8-2-1-7(12-8)9(14)11-6-3-4-10-5-6/h6-7,10H,1-5H2,(H,11,14)(H,12,13)/t6-,7-/m0/s1
InChIKeyDUDXKLFBTTUGKE-BQBZGAKWSA-N
MW197.24 g/mol
LogP-1.26
Rot. Bonds2

About (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide

(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide (PubChem CID 93216020) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide
PubChem CID93216020
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide
SMILESO=C1CC[C@@H](C(=O)N[C@H]2CCNC2)N1
InChIInChI=1S/C9H15N3O2/c13-8-2-1-7(12-8)9(14)11-6-3-4-10-5-6/h6-7,10H,1-5H2,(H,11,14)(H,12,13)/t6-,7-/m0/s1
InChIKeyDUDXKLFBTTUGKE-BQBZGAKWSA-N
XLogP-1.26
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-1.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-5-oxo-N-piperidin-3-ylpyrrolidine-2-carboxamide
CID 103805383
(2R)-5-oxo-N-piperidin-4-ylpyrrolidine-2-carboxamide
CID 93299792
N-[4-(methylamino)cyclohexyl]-5-oxopyrrolidine-2-carboxamide
CID 79110439
6-oxo-N-[(3S)-pyrrolidin-3-yl]piperidine-3-carboxamide
CID 83192394
(2R)-N-(4-methylcyclohexyl)-5-oxopyrrolidine-2-carboxamide
CID 127296472
N-(1-methyl-5-oxopyrrolidin-3-yl)-5-oxopyrrolidine-2-carboxamide
CID 110745995
[4-[(5-oxopyrrolidine-2-carbonyl)amino]cyclohexyl] nitrate
CID 67780997
N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 110820011
(2S)-N-pyrrolidin-3-ylpyrrolidine-2-carboxamide
CID 130690073
5-oxo-N-(1-piperidin-3-ylethyl)pyrrolidine-2-carboxamide
CID 62034686
N-(6-oxopiperidin-3-yl)pyrrolidine-3-carboxamide
CID 63663368
N-[(3R)-pyrrolidin-3-yl]piperidine-4-carboxamide
CID 91470745

Frequently Asked Questions

What is the IUPAC name of (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide (CID 93216020) is (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide is O=C1CC[C@@H](C(=O)N[C@H]2CCNC2)N1.
What is the InChIKey of (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide?
The InChIKey is DUDXKLFBTTUGKE-BQBZGAKWSA-N. The full InChI is InChI=1S/C9H15N3O2/c13-8-2-1-7(12-8)9(14)11-6-3-4-10-5-6/h6-7,10H,1-5H2,(H,11,14)(H,12,13)/t6-,7-/m0/s1.
What are the key properties of (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide?
(2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide has a molecular weight of 197.24 g/mol, XLogP of -1.26, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-5-oxo-N-[(3S)-pyrrolidin-3-yl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 93216020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).