2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide

C15H11Cl2N3O — CID 17167118

IUPAC2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H11Cl2N3O/c16-12-3-1-9(5-13(12)17)6-15(21)19-11-2-4-14-10(7-11)8-18-20-14/h1-5,7-8H,6H2,(H,18,20)(H,19,21)
InChIKeyXULJEZJHASYQSP-UHFFFAOYSA-N
MW320.18 g/mol
LogP4.05
Rot. Bonds3

About 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide

2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide (PubChem CID 17167118) has the molecular formula C15H11Cl2N3O and a molecular weight of 320.18 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide
PubChem CID17167118
Molecular FormulaC15H11Cl2N3O
Molecular Weight320.18 g/mol
Exact Mass319.03
IUPAC Name2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide
SMILESO=C(Cc1ccc(Cl)c(Cl)c1)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C15H11Cl2N3O/c16-12-3-1-9(5-13(12)17)6-15(21)19-11-2-4-14-10(7-11)8-18-20-14/h1-5,7-8H,6H2,(H,18,20)(H,19,21)
InChIKeyXULJEZJHASYQSP-UHFFFAOYSA-N
XLogP4.05
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.18
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,4-dichlorophenyl)-N-1H-indazol-5-yl-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxamide
CID 11247002
N-(3,4-dichlorophenyl)-1H-indazole-5-carboxamide
CID 77844601
N-(1H-indazol-5-yl)benzamide
CID 2389948
2-chloro-N-(1H-indazol-5-yl)benzamide
CID 4448318
3-fluoro-N-(1H-indazol-5-yl)benzamide
CID 6466450
4-fluoro-N-(1H-indazol-5-yl)benzamide
CID 17148682
N-(3,4-dichlorobenzyl)-N'-1H-indazol-4-ylurea
CID 9997058
(2R)-1-[1-(3-chlorophenyl)cyclopentanecarbonyl]-N-(1H-indazol-5-yl)pyrrolidine-2-carboxamide
CID 168299719
N-(1H-indazol-5-yl)-2-phenylacetamide
CID 4412719
N-(1H-indazol-5-yl)cyclohexanecarboxamide
CID 3523119
1-(4-(1H-indazol-5-yl)piperazin-1-yl)-2-amino-2-(4-chlorophenyl)ethanone
CID 16662100
1-(4-(1H-indazol-5-ylamino)piperidin-1-yl)-2-amino-2-(3-chlorophenyl)ethanone
CID 16662116

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide (CID 17167118) is 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide is O=C(Cc1ccc(Cl)c(Cl)c1)Nc1ccc2[nH]ncc2c1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide?
The InChIKey is XULJEZJHASYQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O/c16-12-3-1-9(5-13(12)17)6-15(21)19-11-2-4-14-10(7-11)8-18-20-14/h1-5,7-8H,6H2,(H,18,20)(H,19,21).
What are the key properties of 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide?
2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide has a molecular weight of 320.18 g/mol, XLogP of 4.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-(1H-indazol-5-yl)acetamide is sourced from PubChem (CID 17167118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).