N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide

C10H10N4O2 — CID 47293208

IUPACN-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ncccc2O)n[nH]1
InChIInChI=1S/C10H10N4O2/c1-6-5-7(14-13-6)10(16)12-9-8(15)3-2-4-11-9/h2-5,15H,1H3,(H,13,14)(H,11,12,16)
InChIKeyCTOYVYHDPMZYAL-UHFFFAOYSA-N
MW218.22 g/mol
LogP1.07
Rot. Bonds2

About N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide

N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide (PubChem CID 47293208) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide
PubChem CID47293208
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC NameN-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ncccc2O)n[nH]1
InChIInChI=1S/C10H10N4O2/c1-6-5-7(14-13-6)10(16)12-9-8(15)3-2-4-11-9/h2-5,15H,1H3,(H,13,14)(H,11,12,16)
InChIKeyCTOYVYHDPMZYAL-UHFFFAOYSA-N
XLogP1.07
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide (CID 47293208) is N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide is Cc1cc(C(=O)Nc2ncccc2O)n[nH]1.
What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide?
The InChIKey is CTOYVYHDPMZYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-6-5-7(14-13-6)10(16)12-9-8(15)3-2-4-11-9/h2-5,15H,1H3,(H,13,14)(H,11,12,16).
What are the key properties of N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide?
N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide has a molecular weight of 218.22 g/mol, XLogP of 1.07, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-pyridinyl)-5-methyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 47293208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).