N-methyl-1H-indazole-5-carboxamide

C9H9N3O — CID 22934041

IUPACN-methyl-1H-indazole-5-carboxamide
SMILESCNC(=O)c1ccc2[nH]ncc2c1
InChIInChI=1S/C9H9N3O/c1-10-9(13)6-2-3-8-7(4-6)5-11-12-8/h2-5H,1H3,(H,10,13)(H,11,12)
InChIKeyCSTBSTICBFYTGJ-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.92
Rot. Bonds1

About N-methyl-1H-indazole-5-carboxamide

N-methyl-1H-indazole-5-carboxamide (PubChem CID 22934041) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is N-methyl-1H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-1H-indazole-5-carboxamide
PubChem CID22934041
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC NameN-methyl-1H-indazole-5-carboxamide
SMILESCNC(=O)c1ccc2[nH]ncc2c1
InChIInChI=1S/C9H9N3O/c1-10-9(13)6-2-3-8-7(4-6)5-11-12-8/h2-5H,1H3,(H,10,13)(H,11,12)
InChIKeyCSTBSTICBFYTGJ-UHFFFAOYSA-N
XLogP0.92
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1H-indazole-5-carboxamide?
The IUPAC name of N-methyl-1H-indazole-5-carboxamide (CID 22934041) is N-methyl-1H-indazole-5-carboxamide.
What is the SMILES notation for N-methyl-1H-indazole-5-carboxamide?
The canonical SMILES for N-methyl-1H-indazole-5-carboxamide is CNC(=O)c1ccc2[nH]ncc2c1.
What is the InChIKey of N-methyl-1H-indazole-5-carboxamide?
The InChIKey is CSTBSTICBFYTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-10-9(13)6-2-3-8-7(4-6)5-11-12-8/h2-5H,1H3,(H,10,13)(H,11,12).
What are the key properties of N-methyl-1H-indazole-5-carboxamide?
N-methyl-1H-indazole-5-carboxamide has a molecular weight of 175.19 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1H-indazole-5-carboxamide is sourced from PubChem (CID 22934041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).