N-(1H-indazol-5-ylmethyl)acetamide

C10H11N3O — CID 139515589

IUPACN-(1H-indazol-5-ylmethyl)acetamide
SMILESCC(=O)NCc1ccc2[nH]ncc2c1
InChIInChI=1S/C10H11N3O/c1-7(14)11-5-8-2-3-10-9(4-8)6-12-13-10/h2-4,6H,5H2,1H3,(H,11,14)(H,12,13)
InChIKeyHLISOCFZUBIOAM-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.20
Rot. Bonds2

About N-(1H-indazol-5-ylmethyl)acetamide

N-(1H-indazol-5-ylmethyl)acetamide (PubChem CID 139515589) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is N-(1H-indazol-5-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(1H-indazol-5-ylmethyl)acetamide
PubChem CID139515589
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC NameN-(1H-indazol-5-ylmethyl)acetamide
SMILESCC(=O)NCc1ccc2[nH]ncc2c1
InChIInChI=1S/C10H11N3O/c1-7(14)11-5-8-2-3-10-9(4-8)6-12-13-10/h2-4,6H,5H2,1H3,(H,11,14)(H,12,13)
InChIKeyHLISOCFZUBIOAM-UHFFFAOYSA-N
XLogP1.20
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-5-ylmethyl)acetamide?
The IUPAC name of N-(1H-indazol-5-ylmethyl)acetamide (CID 139515589) is N-(1H-indazol-5-ylmethyl)acetamide.
What is the SMILES notation for N-(1H-indazol-5-ylmethyl)acetamide?
The canonical SMILES for N-(1H-indazol-5-ylmethyl)acetamide is CC(=O)NCc1ccc2[nH]ncc2c1.
What is the InChIKey of N-(1H-indazol-5-ylmethyl)acetamide?
The InChIKey is HLISOCFZUBIOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-7(14)11-5-8-2-3-10-9(4-8)6-12-13-10/h2-4,6H,5H2,1H3,(H,11,14)(H,12,13).
What are the key properties of N-(1H-indazol-5-ylmethyl)acetamide?
N-(1H-indazol-5-ylmethyl)acetamide has a molecular weight of 189.22 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-5-ylmethyl)acetamide is sourced from PubChem (CID 139515589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).