2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide

C13H17N5O — CID 47079618

IUPAC2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide
SMILESCCc1cc(NC(=O)c2ccnc(N(C)C)c2)n[nH]1
InChIInChI=1S/C13H17N5O/c1-4-10-8-11(17-16-10)15-13(19)9-5-6-14-12(7-9)18(2)3/h5-8H,4H2,1-3H3,(H2,15,16,17,19)
InChIKeyGTTHEFMWRQQFMO-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.69
Rot. Bonds4

About 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide

2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide (PubChem CID 47079618) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide
PubChem CID47079618
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide
SMILESCCc1cc(NC(=O)c2ccnc(N(C)C)c2)n[nH]1
InChIInChI=1S/C13H17N5O/c1-4-10-8-11(17-16-10)15-13(19)9-5-6-14-12(7-9)18(2)3/h5-8H,4H2,1-3H3,(H2,15,16,17,19)
InChIKeyGTTHEFMWRQQFMO-UHFFFAOYSA-N
XLogP1.69
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide (CID 47079618) is 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide is CCc1cc(NC(=O)c2ccnc(N(C)C)c2)n[nH]1.
What is the InChIKey of 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide?
The InChIKey is GTTHEFMWRQQFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-4-10-8-11(17-16-10)15-13(19)9-5-6-14-12(7-9)18(2)3/h5-8H,4H2,1-3H3,(H2,15,16,17,19).
What are the key properties of 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide?
2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 47079618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).