N-(1H-indazol-6-yl)acetamide

C9H9N3O — CID 4198553

IUPACN-(1H-indazol-6-yl)acetamide
SMILESCC(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C9H9N3O/c1-6(13)11-8-3-2-7-5-10-12-9(7)4-8/h2-5H,1H3,(H,10,12)(H,11,13)
InChIKeyHOQHKYACTYMRFK-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.52
Rot. Bonds1

About N-(1H-indazol-6-yl)acetamide

N-(1H-indazol-6-yl)acetamide (PubChem CID 4198553) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)acetamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)acetamide
PubChem CID4198553
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC NameN-(1H-indazol-6-yl)acetamide
SMILESCC(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C9H9N3O/c1-6(13)11-8-3-2-7-5-10-12-9(7)4-8/h2-5H,1H3,(H,10,12)(H,11,13)
InChIKeyHOQHKYACTYMRFK-UHFFFAOYSA-N
XLogP1.52
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 ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)acetamide?
The IUPAC name of N-(1H-indazol-6-yl)acetamide (CID 4198553) is N-(1H-indazol-6-yl)acetamide.
What is the SMILES notation for N-(1H-indazol-6-yl)acetamide?
The canonical SMILES for N-(1H-indazol-6-yl)acetamide is CC(=O)Nc1ccc2cn[nH]c2c1.
What is the InChIKey of N-(1H-indazol-6-yl)acetamide?
The InChIKey is HOQHKYACTYMRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-6(13)11-8-3-2-7-5-10-12-9(7)4-8/h2-5H,1H3,(H,10,12)(H,11,13).
What are the key properties of N-(1H-indazol-6-yl)acetamide?
N-(1H-indazol-6-yl)acetamide has a molecular weight of 175.19 g/mol, XLogP of 1.52, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)acetamide is sourced from PubChem (CID 4198553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).