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

C11H15N5O — CID 170951861

IUPAC1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)Nc2ccn[nH]2)n(C)n1
InChIInChI=1S/C11H15N5O/c1-7(2)8-6-9(16(3)15-8)11(17)13-10-4-5-12-14-10/h4-7H,1-3H3,(H2,12,13,14,17)
InChIKeyWLXMQPZCWYANTJ-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.52
Rot. Bonds3

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

1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide (PubChem CID 170951861) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
PubChem CID170951861
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)Nc2ccn[nH]2)n(C)n1
InChIInChI=1S/C11H15N5O/c1-7(2)8-6-9(16(3)15-8)11(17)13-10-4-5-12-14-10/h4-7H,1-3H3,(H2,12,13,14,17)
InChIKeyWLXMQPZCWYANTJ-UHFFFAOYSA-N
XLogP1.52
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-(1H-pyrazol-5-yl)triazole-4-carboxamide
CID 175923694
3-(2,2-difluoropropoxy)-1-methyl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
CID 169142669
1,3-diethyl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide
CID 66120821
1-propyl-N-(1H-pyrazol-5-yl)pyrrole-2-carboxamide
CID 61394373
1-methyl-4-nitro-N-(1H-pyrazol-5-yl)pyrrole-2-carboxamide
CID 61393253
1-(1-methyl-3-propan-2-ylpyrazol-5-yl)ethanone
CID 82376195
methyl 1-methyl-3-propan-2-ylpyrazole-5-carboxylate
CID 25248219
2-(2-hydroxyethyl)-N-(1H-pyrazol-5-yl)pyrazole-3-carboxamide
CID 175923670
2-methoxy-N-(1H-pyrazol-5-yl)propanamide
CID 115596669
2-methyl-2-[4-[(1-methyl-3-propan-2-ylpyrazole-5-carbonyl)amino]pyrazol-1-yl]propanoic acid
CID 120696927
1-methyl-N-[2-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylpyrazole-5-carboxamide
CID 171679225
2,5-dimethyl-N-[4-(1H-pyrazol-5-yl)phenyl]pyrazole-3-carboxamide
CID 61069082

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide?
The IUPAC name of 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide (CID 170951861) is 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide.
What is the SMILES notation for 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide?
The canonical SMILES for 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide is CC(C)c1cc(C(=O)Nc2ccn[nH]2)n(C)n1.
What is the InChIKey of 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide?
The InChIKey is WLXMQPZCWYANTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-7(2)8-6-9(16(3)15-8)11(17)13-10-4-5-12-14-10/h4-7H,1-3H3,(H2,12,13,14,17).
What are the key properties of 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide?
1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide has a molecular weight of 233.27 g/mol, XLogP of 1.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-propan-2-yl-N-(1H-pyrazol-5-yl)pyrazole-5-carboxamide is sourced from PubChem (CID 170951861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).