2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide

C12H14N4O — CID 122569455

IUPAC2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide
SMILESCCn1nccc1-c1nc(C)ccc1C(N)=O
InChIInChI=1S/C12H14N4O/c1-3-16-10(6-7-14-16)11-9(12(13)17)5-4-8(2)15-11/h4-7H,3H2,1-2H3,(H2,13,17)
InChIKeyQNWOBAFSCSLNEZ-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.37
Rot. Bonds3

About 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide

2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide (PubChem CID 122569455) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide
PubChem CID122569455
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide
SMILESCCn1nccc1-c1nc(C)ccc1C(N)=O
InChIInChI=1S/C12H14N4O/c1-3-16-10(6-7-14-16)11-9(12(13)17)5-4-8(2)15-11/h4-7H,3H2,1-2H3,(H2,13,17)
InChIKeyQNWOBAFSCSLNEZ-UHFFFAOYSA-N
XLogP1.37
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide (CID 122569455) is 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide is CCn1nccc1-c1nc(C)ccc1C(N)=O.
What is the InChIKey of 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide?
The InChIKey is QNWOBAFSCSLNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-3-16-10(6-7-14-16)11-9(12(13)17)5-4-8(2)15-11/h4-7H,3H2,1-2H3,(H2,13,17).
What are the key properties of 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide?
2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide has a molecular weight of 230.27 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 122569455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).