5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide

C9H10N4O — CID 67376711

IUPAC5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide
SMILESNC(=O)C1=C(c2ccncc2)NNC1
InChIInChI=1S/C9H10N4O/c10-9(14)7-5-12-13-8(7)6-1-3-11-4-2-6/h1-4,12-13H,5H2,(H2,10,14)
InChIKeyHDMBYGCFMRGKJP-UHFFFAOYSA-N
MW190.21 g/mol
LogP-0.61
Rot. Bonds2

About 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide

5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide (PubChem CID 67376711) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide
PubChem CID67376711
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide
SMILESNC(=O)C1=C(c2ccncc2)NNC1
InChIInChI=1S/C9H10N4O/c10-9(14)7-5-12-13-8(7)6-1-3-11-4-2-6/h1-4,12-13H,5H2,(H2,10,14)
InChIKeyHDMBYGCFMRGKJP-UHFFFAOYSA-N
XLogP-0.61
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 5-0.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide (CID 67376711) is 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide is NC(=O)C1=C(c2ccncc2)NNC1.
What is the InChIKey of 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide?
The InChIKey is HDMBYGCFMRGKJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c10-9(14)7-5-12-13-8(7)6-1-3-11-4-2-6/h1-4,12-13H,5H2,(H2,10,14).
What are the key properties of 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide?
5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide has a molecular weight of 190.21 g/mol, XLogP of -0.61, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-4-yl-2,3-dihydro-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 67376711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).