2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide

C13H19N5O — CID 71934871

IUPAC2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide
SMILESCC(C)Cc1cc(NC(=O)c2ccnn2C)n(C)n1
InChIInChI=1S/C13H19N5O/c1-9(2)7-10-8-12(18(4)16-10)15-13(19)11-5-6-14-17(11)3/h5-6,8-9H,7H2,1-4H3,(H,15,19)
InChIKeyYXFVSYVIHCWSPP-UHFFFAOYSA-N
MW261.33 g/mol
LogP1.60
Rot. Bonds4

About 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide

2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide (PubChem CID 71934871) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide
PubChem CID71934871
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC Name2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide
SMILESCC(C)Cc1cc(NC(=O)c2ccnn2C)n(C)n1
InChIInChI=1S/C13H19N5O/c1-9(2)7-10-8-12(18(4)16-10)15-13(19)11-5-6-14-17(11)3/h5-6,8-9H,7H2,1-4H3,(H,15,19)
InChIKeyYXFVSYVIHCWSPP-UHFFFAOYSA-N
XLogP1.60
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]-1H-indazole-3-carboxamide
CID 49217845
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CID 19475610
2-methyl-N-(4-propan-2-ylphenyl)pyrazole-3-carboxamide
CID 110467120
2-methyl-N'-(2-methylpyrazole-3-carbonyl)pyrazole-3-carbohydrazide
CID 899926
N-[4-(aminomethyl)phenyl]-2-methylpyrazole-3-carboxamide
CID 62920449
N-(1-hydroxy-4-methylpentan-2-yl)-2-methylpyrazole-3-carboxamide
CID 61246953
N-(1-bromo-4-methylpentan-2-yl)-2-methylpyrazole-3-carboxamide
CID 114311618
(2R)-2-[(2-methylpyrazole-3-carbonyl)amino]propanoic acid
CID 78972778
2,3-dimethyl-1-(2-methylpyrazol-3-yl)butan-1-one
CID 114972564
N-(4-ethylphenyl)-2-methylpyrazole-3-carboxamide
CID 6464324
2-[5-[(2,5-dimethylpyrazol-3-yl)carbamoyl]pyrazol-1-yl]acetic acid
CID 19482723
N-(1-amino-4-methylpentan-2-yl)-2-methylpyrazole-3-carboxamide
CID 63754352

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide?
The IUPAC name of 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide (CID 71934871) is 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide?
The canonical SMILES for 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide is CC(C)Cc1cc(NC(=O)c2ccnn2C)n(C)n1.
What is the InChIKey of 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide?
The InChIKey is YXFVSYVIHCWSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-9(2)7-10-8-12(18(4)16-10)15-13(19)11-5-6-14-17(11)3/h5-6,8-9H,7H2,1-4H3,(H,15,19).
What are the key properties of 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide?
2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide has a molecular weight of 261.33 g/mol, XLogP of 1.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-methyl-3-(2-methylpropyl)pyrazol-5-yl]pyrazole-3-carboxamide is sourced from PubChem (CID 71934871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).