N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide

C13H9N3O3 — CID 62686015

IUPACN-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)c1ccc(=O)oc1
InChIInChI=1S/C13H9N3O3/c17-11-6-5-8(7-19-11)13(18)14-12-9-3-1-2-4-10(9)15-16-12/h1-7H,(H2,14,15,16,18)
InChIKeyVTBMEUCAFIRFRT-UHFFFAOYSA-N
MW255.23 g/mol
LogP1.77
Rot. Bonds2

About N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide

N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide (PubChem CID 62686015) has the molecular formula C13H9N3O3 and a molecular weight of 255.23 g/mol. Its IUPAC name is N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide.

Molecular Properties

Compound NameN-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide
PubChem CID62686015
Molecular FormulaC13H9N3O3
Molecular Weight255.23 g/mol
Exact Mass255.06
IUPAC NameN-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)c1ccc(=O)oc1
InChIInChI=1S/C13H9N3O3/c17-11-6-5-8(7-19-11)13(18)14-12-9-3-1-2-4-10(9)15-16-12/h1-7H,(H2,14,15,16,18)
InChIKeyVTBMEUCAFIRFRT-UHFFFAOYSA-N
XLogP1.77
TPSA87.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-(1H-indazol-3-yl)benzamide
CID 12913046
N-(1H-indazol-3-yl)-3-methylfuran-2-carboxamide
CID 60730334
N-(1H-indazol-3-yl)pyrazine-2-carboxamide
CID 60729729
1-(4-acetylphenyl)-3-(1H-indazol-3-yl)urea
CID 25197518
N-(1H-indazol-3-yl)imidazo[1,5-a]pyridine-7-carboxamide
CID 112527857
3-benzamido-1H-indazole-5-carboxylic acid
CID 129093990
N-(1H-indazol-3-yl)-3,4-dimethyl-6-oxo-1H-pyridazine-5-carboxamide
CID 61068182
N-(1H-indazol-3-yl)prop-2-enamide
CID 62686025
6-oxo-N-(1H-1,2,4-triazol-5-yl)pyran-3-carboxamide
CID 60722966
5-chloro-N-(1H-indazol-3-yl)thiophene-2-carboxamide
CID 60735598
2,5-dichloro-N-(1H-indazol-3-yl)benzamide
CID 60729962
4-bromo-N-(1H-indazol-3-yl)-2-methylbenzamide
CID 61068511

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide?
The IUPAC name of N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide (CID 62686015) is N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide.
What is the SMILES notation for N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide?
The canonical SMILES for N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide is O=C(Nc1n[nH]c2ccccc12)c1ccc(=O)oc1.
What is the InChIKey of N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide?
The InChIKey is VTBMEUCAFIRFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O3/c17-11-6-5-8(7-19-11)13(18)14-12-9-3-1-2-4-10(9)15-16-12/h1-7H,(H2,14,15,16,18).
What are the key properties of N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide?
N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide has a molecular weight of 255.23 g/mol, XLogP of 1.77, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-3-yl)-6-oxopyran-3-carboxamide is sourced from PubChem (CID 62686015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).