2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide

C12H20N4O — CID 79388175

IUPAC2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
SMILESCC(Cn1cccn1)NC(=O)C1CCNC1C
InChIInChI=1S/C12H20N4O/c1-9(8-16-7-3-5-14-16)15-12(17)11-4-6-13-10(11)2/h3,5,7,9-11,13H,4,6,8H2,1-2H3,(H,15,17)
InChIKeyTWEZFNHMDNLUAS-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.39
Rot. Bonds4

About 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide

2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide (PubChem CID 79388175) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
PubChem CID79388175
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide
SMILESCC(Cn1cccn1)NC(=O)C1CCNC1C
InChIInChI=1S/C12H20N4O/c1-9(8-16-7-3-5-14-16)15-12(17)11-4-6-13-10(11)2/h3,5,7,9-11,13H,4,6,8H2,1-2H3,(H,15,17)
InChIKeyTWEZFNHMDNLUAS-UHFFFAOYSA-N
XLogP0.39
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(1-pyrazol-1-ylpropan-2-yl)cyclopentane-1-carboxamide
CID 64824492
4-ethyl-2-(1-pyrazol-1-ylpropan-2-ylcarbamoyl)cyclopentane-1-carboxylic acid
CID 114511550
(2R)-5-oxo-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrrolidine-2-carboxamide
CID 94820968
3-(1-pyrazol-1-ylpropan-2-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 63784341
N-(1-pyrazol-1-ylpropan-2-yl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119958433
N-(1-ethoxypropan-2-yl)-2-methylpyrrolidine-3-carboxamide
CID 79388083
3-methyl-N-(1-pyrazol-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115583842
(2S,3S)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-(1,3,5-trimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 129326780
1,1-diethyl-3-(1-pyrazol-1-ylpropan-2-yl)urea
CID 115583841
N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide
CID 94031085
2-[(2-methylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 79388540
2-(1-pyrazol-1-ylpropan-2-ylcarbamoylamino)butanoic acid
CID 54951710

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide?
The IUPAC name of 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide (CID 79388175) is 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide is CC(Cn1cccn1)NC(=O)C1CCNC1C.
What is the InChIKey of 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide?
The InChIKey is TWEZFNHMDNLUAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9(8-16-7-3-5-14-16)15-12(17)11-4-6-13-10(11)2/h3,5,7,9-11,13H,4,6,8H2,1-2H3,(H,15,17).
What are the key properties of 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide?
2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-pyrazol-1-ylpropan-2-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 79388175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).