6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide

C13H16N4O — CID 77097135

IUPAC6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide
SMILESCc1n[nH]c(C)c1-c1cccc(C(=O)N(C)C)n1
InChIInChI=1S/C13H16N4O/c1-8-12(9(2)16-15-8)10-6-5-7-11(14-10)13(18)17(3)4/h5-7H,1-4H3,(H,15,16)
InChIKeyUSOSUDXFKGTFAZ-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.79
Rot. Bonds2

About 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide

6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide (PubChem CID 77097135) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide
PubChem CID77097135
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide
SMILESCc1n[nH]c(C)c1-c1cccc(C(=O)N(C)C)n1
InChIInChI=1S/C13H16N4O/c1-8-12(9(2)16-15-8)10-6-5-7-11(14-10)13(18)17(3)4/h5-7H,1-4H3,(H,15,16)
InChIKeyUSOSUDXFKGTFAZ-UHFFFAOYSA-N
XLogP1.79
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide?
The IUPAC name of 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide (CID 77097135) is 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide?
The canonical SMILES for 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide is Cc1n[nH]c(C)c1-c1cccc(C(=O)N(C)C)n1.
What is the InChIKey of 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide?
The InChIKey is USOSUDXFKGTFAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-8-12(9(2)16-15-8)10-6-5-7-11(14-10)13(18)17(3)4/h5-7H,1-4H3,(H,15,16).
What are the key properties of 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide?
6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide has a molecular weight of 244.30 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethyl-1H-pyrazol-4-yl)-N,N-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 77097135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).