2-cyano-N-(1H-indazol-7-yl)acetamide

C10H8N4O — CID 110470078

IUPAC2-cyano-N-(1H-indazol-7-yl)acetamide
SMILESN#CCC(=O)Nc1cccc2cn[nH]c12
InChIInChI=1S/C10H8N4O/c11-5-4-9(15)13-8-3-1-2-7-6-12-14-10(7)8/h1-3,6H,4H2,(H,12,14)(H,13,15)
InChIKeyDZHZRHCRCUPJCZ-UHFFFAOYSA-N
MW200.20 g/mol
LogP1.42
Rot. Bonds2

About 2-cyano-N-(1H-indazol-7-yl)acetamide

2-cyano-N-(1H-indazol-7-yl)acetamide (PubChem CID 110470078) has the molecular formula C10H8N4O and a molecular weight of 200.20 g/mol. Its IUPAC name is 2-cyano-N-(1H-indazol-7-yl)acetamide.

Molecular Properties

Compound Name2-cyano-N-(1H-indazol-7-yl)acetamide
PubChem CID110470078
Molecular FormulaC10H8N4O
Molecular Weight200.20 g/mol
Exact Mass200.07
IUPAC Name2-cyano-N-(1H-indazol-7-yl)acetamide
SMILESN#CCC(=O)Nc1cccc2cn[nH]c12
InChIInChI=1S/C10H8N4O/c11-5-4-9(15)13-8-3-1-2-7-6-12-14-10(7)8/h1-3,6H,4H2,(H,12,14)(H,13,15)
InChIKeyDZHZRHCRCUPJCZ-UHFFFAOYSA-N
XLogP1.42
TPSA81.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(1H-indazol-7-yl)acetamide?
The IUPAC name of 2-cyano-N-(1H-indazol-7-yl)acetamide (CID 110470078) is 2-cyano-N-(1H-indazol-7-yl)acetamide.
What is the SMILES notation for 2-cyano-N-(1H-indazol-7-yl)acetamide?
The canonical SMILES for 2-cyano-N-(1H-indazol-7-yl)acetamide is N#CCC(=O)Nc1cccc2cn[nH]c12.
What is the InChIKey of 2-cyano-N-(1H-indazol-7-yl)acetamide?
The InChIKey is DZHZRHCRCUPJCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O/c11-5-4-9(15)13-8-3-1-2-7-6-12-14-10(7)8/h1-3,6H,4H2,(H,12,14)(H,13,15).
What are the key properties of 2-cyano-N-(1H-indazol-7-yl)acetamide?
2-cyano-N-(1H-indazol-7-yl)acetamide has a molecular weight of 200.20 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(1H-indazol-7-yl)acetamide is sourced from PubChem (CID 110470078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).