N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide

C15H12N4O2 — CID 167900619

IUPACN-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide
SMILESO=C(Nc1ccccc1O)c1cn[nH]c1-c1cccnc1
InChIInChI=1S/C15H12N4O2/c20-13-6-2-1-5-12(13)18-15(21)11-9-17-19-14(11)10-4-3-7-16-8-10/h1-9,20H,(H,17,19)(H,18,21)
InChIKeyCTQGACKPOJCHMM-UHFFFAOYSA-N
MW280.29 g/mol
LogP2.43
Rot. Bonds3

About N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide

N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide (PubChem CID 167900619) has the molecular formula C15H12N4O2 and a molecular weight of 280.29 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide
PubChem CID167900619
Molecular FormulaC15H12N4O2
Molecular Weight280.29 g/mol
Exact Mass280.10
IUPAC NameN-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide
SMILESO=C(Nc1ccccc1O)c1cn[nH]c1-c1cccnc1
InChIInChI=1S/C15H12N4O2/c20-13-6-2-1-5-12(13)18-15(21)11-9-17-19-14(11)10-4-3-7-16-8-10/h1-9,20H,(H,17,19)(H,18,21)
InChIKeyCTQGACKPOJCHMM-UHFFFAOYSA-N
XLogP2.43
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyphenyl)-4-pyridin-3-ylbenzamide
CID 59672983
5-pyridin-3-yl-N-(3-pyridin-4-yloxyphenyl)-1H-pyrazole-4-carboxamide
CID 166203360
N-(2-hydroxyphenyl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 39889991
5-(4-fluorophenyl)-N-(3-pyridin-3-yl-1,2,4-thiadiazol-5-yl)-1H-pyrazole-4-carboxamide
CID 167960338
5-pyridin-3-yl-N-[(2S,3S)-1,1,1-trifluoro-2-hydroxy-4-methylpentan-3-yl]-1H-pyrazole-4-carboxamide
CID 138035360
3-chloro-N-(2-hydroxyphenyl)pyridine-4-carboxamide
CID 103715642
N-[(2S)-2-(3-chlorophenyl)-2-hydroxyethyl]-5-pyridin-3-yl-1H-pyrazole-4-carboxamide
CID 155944607
N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-5-pyridin-3-yl-1H-pyrazole-4-carboxamide
CID 95316928
N-(5-methyl-1H-pyrazol-3-yl)-5-phenyl-1H-pyrazole-4-carboxamide
CID 63819414
2-iodo-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]aniline
CID 43773509
(5-pyridin-3-yl-1H-pyrazol-4-yl)methanol
CID 43753528
4-methyl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 166192549

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide (CID 167900619) is N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide is O=C(Nc1ccccc1O)c1cn[nH]c1-c1cccnc1.
What is the InChIKey of N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide?
The InChIKey is CTQGACKPOJCHMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O2/c20-13-6-2-1-5-12(13)18-15(21)11-9-17-19-14(11)10-4-3-7-16-8-10/h1-9,20H,(H,17,19)(H,18,21).
What are the key properties of N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide?
N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide has a molecular weight of 280.29 g/mol, XLogP of 2.43, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-5-pyridin-3-yl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 167900619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).