1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide

C13H20N4O2 — CID 106321245

IUPAC1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(C(=O)c2c(C)n[nH]c2C)C1
InChIInChI=1S/C13H20N4O2/c1-8-10(9(2)16-15-8)11(18)17-6-5-13(3,7-17)12(19)14-4/h5-7H2,1-4H3,(H,14,19)(H,15,16)
InChIKeyNNEWYQVFKZCNCB-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.62
Rot. Bonds2

About 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide

1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide (PubChem CID 106321245) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
PubChem CID106321245
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(C(=O)c2c(C)n[nH]c2C)C1
InChIInChI=1S/C13H20N4O2/c1-8-10(9(2)16-15-8)11(18)17-6-5-13(3,7-17)12(19)14-4/h5-7H2,1-4H3,(H,14,19)(H,15,16)
InChIKeyNNEWYQVFKZCNCB-UHFFFAOYSA-N
XLogP0.62
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-4-methylpiperidine-4-carboxylic acid
CID 63123584
1-(5-ethyl-1H-1,2,4-triazole-3-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321230
1-(2,6-dichloropyridine-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106151782
1-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 63149532
1-(4-amino-3-methylbenzoyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106317442
1-[4-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-1,4-diazepan-1-yl]ethanone
CID 55003136
(3,5-dimethyl-1H-pyrazol-4-yl)-[(3S)-3-methylpiperazin-1-yl]methanone
CID 104976335
1-N,1-N,3-N,3-tetramethylpyrrolidine-1,3-dicarboxamide
CID 106132532
1-(2-aminoacetyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318155
(3,4-dihydroxypyrrolidin-1-yl)-(3,5-dimethyl-1H-pyrazol-4-yl)methanone
CID 106673072
1-[4-(chloromethyl)benzoyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106317992
1-(2-hydroxy-2-methylpropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318601

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide (CID 106321245) is 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide is CNC(=O)C1(C)CCN(C(=O)c2c(C)n[nH]c2C)C1.
What is the InChIKey of 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The InChIKey is NNEWYQVFKZCNCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-8-10(9(2)16-15-8)11(18)17-6-5-13(3,7-17)12(19)14-4/h5-7H2,1-4H3,(H,14,19)(H,15,16).
What are the key properties of 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide?
1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106321245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).