2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide

C15H12ClN3O — CID 156907146

IUPAC2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1cccc2[nH]ncc12
InChIInChI=1S/C15H12ClN3O/c16-11-4-1-3-10(7-11)8-15(20)18-13-5-2-6-14-12(13)9-17-19-14/h1-7,9H,8H2,(H,17,19)(H,18,20)
InChIKeyCYQCEAJKJVOFMS-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.40
Rot. Bonds3

About 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide

2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide (PubChem CID 156907146) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide
PubChem CID156907146
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC Name2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1cccc2[nH]ncc12
InChIInChI=1S/C15H12ClN3O/c16-11-4-1-3-10(7-11)8-15(20)18-13-5-2-6-14-12(13)9-17-19-14/h1-7,9H,8H2,(H,17,19)(H,18,20)
InChIKeyCYQCEAJKJVOFMS-UHFFFAOYSA-N
XLogP3.40
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide (CID 156907146) is 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide is O=C(Cc1cccc(Cl)c1)Nc1cccc2[nH]ncc12.
What is the InChIKey of 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide?
The InChIKey is CYQCEAJKJVOFMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c16-11-4-1-3-10(7-11)8-15(20)18-13-5-2-6-14-12(13)9-17-19-14/h1-7,9H,8H2,(H,17,19)(H,18,20).
What are the key properties of 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide?
2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide has a molecular weight of 285.73 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(1H-indazol-4-yl)acetamide is sourced from PubChem (CID 156907146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).