N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide

C14H9Cl2N3O — CID 43048604

IUPACN-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1cccc2cn[nH]c12
InChIInChI=1S/C14H9Cl2N3O/c15-11-5-4-9(6-12(11)16)18-14(20)10-3-1-2-8-7-17-19-13(8)10/h1-7H,(H,17,19)(H,18,20)
InChIKeyGKKOXTWGHBGBLP-UHFFFAOYSA-N
MW306.15 g/mol
LogP4.12
Rot. Bonds2

About N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide

N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide (PubChem CID 43048604) has the molecular formula C14H9Cl2N3O and a molecular weight of 306.15 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide
PubChem CID43048604
Molecular FormulaC14H9Cl2N3O
Molecular Weight306.15 g/mol
Exact Mass305.01
IUPAC NameN-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1cccc2cn[nH]c12
InChIInChI=1S/C14H9Cl2N3O/c15-11-5-4-9(6-12(11)16)18-14(20)10-3-1-2-8-7-17-19-13(8)10/h1-7H,(H,17,19)(H,18,20)
InChIKeyGKKOXTWGHBGBLP-UHFFFAOYSA-N
XLogP4.12
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.15
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide (CID 43048604) is N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1cccc2cn[nH]c12.
What is the InChIKey of N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide?
The InChIKey is GKKOXTWGHBGBLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2N3O/c15-11-5-4-9(6-12(11)16)18-14(20)10-3-1-2-8-7-17-19-13(8)10/h1-7H,(H,17,19)(H,18,20).
What are the key properties of N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide?
N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide has a molecular weight of 306.15 g/mol, XLogP of 4.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-1H-indazole-7-carboxamide is sourced from PubChem (CID 43048604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).