(2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide

C10H14N4O2 — CID 119031944

IUPAC(2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCN1C(=O)C[C@@H](C(N)=O)[C@@H]1c1ccnn1C
InChIInChI=1S/C10H14N4O2/c1-13-8(15)5-6(10(11)16)9(13)7-3-4-12-14(7)2/h3-4,6,9H,5H2,1-2H3,(H2,11,16)/t6-,9-/m1/s1
InChIKeyOLZWLUWVBMYNCZ-HZGVNTEJSA-N
MW222.25 g/mol
LogP-0.58
Rot. Bonds2

About (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide

(2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 119031944) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID119031944
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name(2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCN1C(=O)C[C@@H](C(N)=O)[C@@H]1c1ccnn1C
InChIInChI=1S/C10H14N4O2/c1-13-8(15)5-6(10(11)16)9(13)7-3-4-12-14(7)2/h3-4,6,9H,5H2,1-2H3,(H2,11,16)/t6-,9-/m1/s1
InChIKeyOLZWLUWVBMYNCZ-HZGVNTEJSA-N
XLogP-0.58
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide (CID 119031944) is (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide is CN1C(=O)C[C@@H](C(N)=O)[C@@H]1c1ccnn1C.
What is the InChIKey of (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is OLZWLUWVBMYNCZ-HZGVNTEJSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-13-8(15)5-6(10(11)16)9(13)7-3-4-12-14(7)2/h3-4,6,9H,5H2,1-2H3,(H2,11,16)/t6-,9-/m1/s1.
What are the key properties of (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide?
(2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 222.25 g/mol, XLogP of -0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-1-methyl-2-(2-methylpyrazol-3-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 119031944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).