1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide

C10H17N3O — CID 19279617

IUPAC1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCC(C)C)nn1C
InChIInChI=1S/C10H17N3O/c1-7(2)6-11-10(14)9-5-8(3)13(4)12-9/h5,7H,6H2,1-4H3,(H,11,14)
InChIKeyGKMALPLOKFLCNP-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.11
Rot. Bonds3

About 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide

1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide (PubChem CID 19279617) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide
PubChem CID19279617
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCC(C)C)nn1C
InChIInChI=1S/C10H17N3O/c1-7(2)6-11-10(14)9-5-8(3)13(4)12-9/h5,7H,6H2,1-4H3,(H,11,14)
InChIKeyGKMALPLOKFLCNP-UHFFFAOYSA-N
XLogP1.11
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide?
The IUPAC name of 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide (CID 19279617) is 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide is Cc1cc(C(=O)NCC(C)C)nn1C.
What is the InChIKey of 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide?
The InChIKey is GKMALPLOKFLCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7(2)6-11-10(14)9-5-8(3)13(4)12-9/h5,7H,6H2,1-4H3,(H,11,14).
What are the key properties of 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide?
1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide has a molecular weight of 195.27 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(2-methylpropyl)pyrazole-3-carboxamide is sourced from PubChem (CID 19279617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).