1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide

C15H24N4O2 — CID 104620104

IUPAC1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
SMILESCc1[nH]nc(NC(=O)C2CCCN2C(=O)C(C)(C)C)c1C
InChIInChI=1S/C15H24N4O2/c1-9-10(2)17-18-12(9)16-13(20)11-7-6-8-19(11)14(21)15(3,4)5/h11H,6-8H2,1-5H3,(H2,16,17,18,20)
InChIKeyALBQTVZSAHGKGJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.00
Rot. Bonds2

About 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide

1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide (PubChem CID 104620104) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
PubChem CID104620104
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
SMILESCc1[nH]nc(NC(=O)C2CCCN2C(=O)C(C)(C)C)c1C
InChIInChI=1S/C15H24N4O2/c1-9-10(2)17-18-12(9)16-13(20)11-7-6-8-19(11)14(21)15(3,4)5/h11H,6-8H2,1-5H3,(H2,16,17,18,20)
InChIKeyALBQTVZSAHGKGJ-UHFFFAOYSA-N
XLogP2.00
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2-dimethylpropanoyl)-N-(5-ethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide
CID 115609289
1-(2,2-dimethylpropanoyl)-N-(4-ethyl-1H-pyrazol-5-yl)pyrrolidine-2-carboxamide
CID 104620312
3-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-1,3-dicarboxamide
CID 112689240
1-(2,2-dimethylpropanoyl)-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide
CID 47184320
1-(2,2-dimethylpropanoyl)-N-(2-hydroxy-4-methylphenyl)pyrrolidine-2-carboxamide
CID 47050528
N-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-1-propanoylpiperidine-2-carboxamide
CID 146123797
1-(2,2-dimethylpropanoyl)-N-(3,4,5-trichlorophenyl)pyrrolidine-2-carboxamide
CID 100972177
N-(3,5-dimethoxyphenyl)-1-(2,2-dimethylpropanoyl)pyrrolidine-2-carboxamide
CID 100972174
(2S)-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-2-carboxamide
CID 104914702
(3S)-N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 104618674
(2R)-2-[(5-methyl-1H-pyrazol-4-yl)carbamoyl]pyrrolidine-1-carboxylic acid
CID 155225300
N-(4,5-dimethyl-1H-pyrazol-3-yl)oxolane-3-carboxamide
CID 115609939

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide (CID 104620104) is 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide is Cc1[nH]nc(NC(=O)C2CCCN2C(=O)C(C)(C)C)c1C.
What is the InChIKey of 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
The InChIKey is ALBQTVZSAHGKGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-9-10(2)17-18-12(9)16-13(20)11-7-6-8-19(11)14(21)15(3,4)5/h11H,6-8H2,1-5H3,(H2,16,17,18,20).
What are the key properties of 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide?
1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropanoyl)-N-(4,5-dimethyl-1H-pyrazol-3-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 104620104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).