N-(3-phenyl-1H-indazol-5-yl)acetamide

C15H13N3O — CID 22479951

IUPACN-(3-phenyl-1H-indazol-5-yl)acetamide
SMILESCC(=O)Nc1ccc2[nH]nc(-c3ccccc3)c2c1
InChIInChI=1S/C15H13N3O/c1-10(19)16-12-7-8-14-13(9-12)15(18-17-14)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyNXVMRZFIAXZZFO-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.19
Rot. Bonds2

About N-(3-phenyl-1H-indazol-5-yl)acetamide

N-(3-phenyl-1H-indazol-5-yl)acetamide (PubChem CID 22479951) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is N-(3-phenyl-1H-indazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(3-phenyl-1H-indazol-5-yl)acetamide
PubChem CID22479951
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC NameN-(3-phenyl-1H-indazol-5-yl)acetamide
SMILESCC(=O)Nc1ccc2[nH]nc(-c3ccccc3)c2c1
InChIInChI=1S/C15H13N3O/c1-10(19)16-12-7-8-14-13(9-12)15(18-17-14)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyNXVMRZFIAXZZFO-UHFFFAOYSA-N
XLogP3.19
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-phenyl-1H-indazol-5-yl)acetamide?
The IUPAC name of N-(3-phenyl-1H-indazol-5-yl)acetamide (CID 22479951) is N-(3-phenyl-1H-indazol-5-yl)acetamide.
What is the SMILES notation for N-(3-phenyl-1H-indazol-5-yl)acetamide?
The canonical SMILES for N-(3-phenyl-1H-indazol-5-yl)acetamide is CC(=O)Nc1ccc2[nH]nc(-c3ccccc3)c2c1.
What is the InChIKey of N-(3-phenyl-1H-indazol-5-yl)acetamide?
The InChIKey is NXVMRZFIAXZZFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-10(19)16-12-7-8-14-13(9-12)15(18-17-14)11-5-3-2-4-6-11/h2-9H,1H3,(H,16,19)(H,17,18).
What are the key properties of N-(3-phenyl-1H-indazol-5-yl)acetamide?
N-(3-phenyl-1H-indazol-5-yl)acetamide has a molecular weight of 251.29 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenyl-1H-indazol-5-yl)acetamide is sourced from PubChem (CID 22479951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).