N-(1H-pyrazol-4-yl)pyridine-3-carboxamide

C9H8N4O — CID 20784957

IUPACN-(1H-pyrazol-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cccnc1
InChIInChI=1S/C9H8N4O/c14-9(7-2-1-3-10-4-7)13-8-5-11-12-6-8/h1-6H,(H,11,12)(H,13,14)
InChIKeyYOVPEUNLYJIRJF-UHFFFAOYSA-N
MW188.19 g/mol
LogP1.06
Rot. Bonds2

About N-(1H-pyrazol-4-yl)pyridine-3-carboxamide

N-(1H-pyrazol-4-yl)pyridine-3-carboxamide (PubChem CID 20784957) has the molecular formula C9H8N4O and a molecular weight of 188.19 g/mol. Its IUPAC name is N-(1H-pyrazol-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrazol-4-yl)pyridine-3-carboxamide
PubChem CID20784957
Molecular FormulaC9H8N4O
Molecular Weight188.19 g/mol
Exact Mass188.07
IUPAC NameN-(1H-pyrazol-4-yl)pyridine-3-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cccnc1
InChIInChI=1S/C9H8N4O/c14-9(7-2-1-3-10-4-7)13-8-5-11-12-6-8/h1-6H,(H,11,12)(H,13,14)
InChIKeyYOVPEUNLYJIRJF-UHFFFAOYSA-N
XLogP1.06
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
The IUPAC name of N-(1H-pyrazol-4-yl)pyridine-3-carboxamide (CID 20784957) is N-(1H-pyrazol-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(1H-pyrazol-4-yl)pyridine-3-carboxamide is O=C(Nc1cn[nH]c1)c1cccnc1.
What is the InChIKey of N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
The InChIKey is YOVPEUNLYJIRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4O/c14-9(7-2-1-3-10-4-7)13-8-5-11-12-6-8/h1-6H,(H,11,12)(H,13,14).
What are the key properties of N-(1H-pyrazol-4-yl)pyridine-3-carboxamide?
N-(1H-pyrazol-4-yl)pyridine-3-carboxamide has a molecular weight of 188.19 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 20784957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).