5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide

C11H12N4O — CID 47293177

IUPAC5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ncccc2C)n[nH]1
InChIInChI=1S/C11H12N4O/c1-7-4-3-5-12-10(7)13-11(16)9-6-8(2)14-15-9/h3-6H,1-2H3,(H,14,15)(H,12,13,16)
InChIKeyQRZZPIRCLHGNBH-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.67
Rot. Bonds2

About 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide

5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide (PubChem CID 47293177) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide
PubChem CID47293177
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC Name5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ncccc2C)n[nH]1
InChIInChI=1S/C11H12N4O/c1-7-4-3-5-12-10(7)13-11(16)9-6-8(2)14-15-9/h3-6H,1-2H3,(H,14,15)(H,12,13,16)
InChIKeyQRZZPIRCLHGNBH-UHFFFAOYSA-N
XLogP1.67
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide (CID 47293177) is 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide is Cc1cc(C(=O)Nc2ncccc2C)n[nH]1.
What is the InChIKey of 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide?
The InChIKey is QRZZPIRCLHGNBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c1-7-4-3-5-12-10(7)13-11(16)9-6-8(2)14-15-9/h3-6H,1-2H3,(H,14,15)(H,12,13,16).
What are the key properties of 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide?
5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(3-methyl-2-pyridinyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 47293177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).