2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide

C12H20N4O — CID 113357162

IUPAC2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
SMILESCC(C)c1cc(NC(=O)C2(C)CCCN2)n[nH]1
InChIInChI=1S/C12H20N4O/c1-8(2)9-7-10(16-15-9)14-11(17)12(3)5-4-6-13-12/h7-8,13H,4-6H2,1-3H3,(H2,14,15,16,17)
InChIKeyRJQBTXMHASDDQS-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.61
Rot. Bonds3

About 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide

2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide (PubChem CID 113357162) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
PubChem CID113357162
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
SMILESCC(C)c1cc(NC(=O)C2(C)CCCN2)n[nH]1
InChIInChI=1S/C12H20N4O/c1-8(2)9-7-10(16-15-9)14-11(17)12(3)5-4-6-13-12/h7-8,13H,4-6H2,1-3H3,(H2,14,15,16,17)
InChIKeyRJQBTXMHASDDQS-UHFFFAOYSA-N
XLogP1.61
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
CID 113433768
1-(2-methylpropyl)-N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclopentane-1-carboxamide
CID 104619916
1-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclohexane-1-carboxamide
CID 113433584
2-methyl-N-(6-oxo-1H-pyridazin-3-yl)piperidine-2-carboxamide
CID 116786879
(2S)-2-methyl-N-pyrazin-2-ylpyrrolidine-2-carboxamide
CID 59436345
N-(5-propan-2-yl-1H-pyrazol-3-yl)cyclooctanecarboxamide
CID 115663305
2-methyl-N-pyridazin-3-ylpyrrolidine-2-carboxamide
CID 116786688
2-cyclobutyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)acetamide
CID 103710671
2-amino-N-(5-propan-2-yl-1H-pyrazol-3-yl)propanamide
CID 115976344
2-methyl-N-(1,2,4-triazin-3-yl)pyrrolidine-2-carboxamide
CID 114387798
N-(5-propan-2-yl-1H-pyrazol-3-yl)-2-pyrrolidin-2-ylacetamide
CID 113433582
2-methyl-N-(2H-tetrazol-5-yl)pyrrolidine-2-carboxamide
CID 131086433

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide (CID 113357162) is 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide is CC(C)c1cc(NC(=O)C2(C)CCCN2)n[nH]1.
What is the InChIKey of 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is RJQBTXMHASDDQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8(2)9-7-10(16-15-9)14-11(17)12(3)5-4-6-13-12/h7-8,13H,4-6H2,1-3H3,(H2,14,15,16,17).
What are the key properties of 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 1.61, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 113357162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).