(2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide

C11H16N4O2 — CID 94820968

IUPAC(2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide
SMILESC[C@@H](Cn1cccn1)NC(=O)[C@H]1CCC(=O)N1
InChIInChI=1S/C11H16N4O2/c1-8(7-15-6-2-5-12-15)13-11(17)9-3-4-10(16)14-9/h2,5-6,8-9H,3-4,7H2,1H3,(H,13,17)(H,14,16)/t8-,9+/m0/s1
InChIKeyWVFFHVIOUSHRFG-DTWKUNHWSA-N
MW236.28 g/mol
LogP-0.33
Rot. Bonds4

About (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide

(2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide (PubChem CID 94820968) has the molecular formula C11H16N4O2 and a molecular weight of 236.28 g/mol. Its IUPAC name is (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide
PubChem CID94820968
Molecular FormulaC11H16N4O2
Molecular Weight236.28 g/mol
Exact Mass236.13
IUPAC Name(2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide
SMILESC[C@@H](Cn1cccn1)NC(=O)[C@H]1CCC(=O)N1
InChIInChI=1S/C11H16N4O2/c1-8(7-15-6-2-5-12-15)13-11(17)9-3-4-10(16)14-9/h2,5-6,8-9H,3-4,7H2,1H3,(H,13,17)(H,14,16)/t8-,9+/m0/s1
InChIKeyWVFFHVIOUSHRFG-DTWKUNHWSA-N
XLogP-0.33
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide (CID 94820968) is (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide is C[C@@H](Cn1cccn1)NC(=O)[C@H]1CCC(=O)N1.
What is the InChIKey of (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide?
The InChIKey is WVFFHVIOUSHRFG-DTWKUNHWSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-8(7-15-6-2-5-12-15)13-11(17)9-3-4-10(16)14-9/h2,5-6,8-9H,3-4,7H2,1H3,(H,13,17)(H,14,16)/t8-,9+/m0/s1.
What are the key properties of (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide?
(2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide has a molecular weight of 236.28 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 94820968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).