2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide

C14H9ClFN3O — CID 5146616

IUPAC2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)c1c(F)cccc1Cl
InChIInChI=1S/C14H9ClFN3O/c15-10-2-1-3-11(16)13(10)14(20)18-9-5-4-8-7-17-19-12(8)6-9/h1-7H,(H,17,19)(H,18,20)
InChIKeyHYVUGTUCERQPEQ-UHFFFAOYSA-N
MW289.70 g/mol
LogP3.61
Rot. Bonds2

About 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide

2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide (PubChem CID 5146616) has the molecular formula C14H9ClFN3O and a molecular weight of 289.70 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide
PubChem CID5146616
Molecular FormulaC14H9ClFN3O
Molecular Weight289.70 g/mol
Exact Mass289.04
IUPAC Name2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide
SMILESO=C(Nc1ccc2cn[nH]c2c1)c1c(F)cccc1Cl
InChIInChI=1S/C14H9ClFN3O/c15-10-2-1-3-11(16)13(10)14(20)18-9-5-4-8-7-17-19-12(8)6-9/h1-7H,(H,17,19)(H,18,20)
InChIKeyHYVUGTUCERQPEQ-UHFFFAOYSA-N
XLogP3.61
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.70
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-4-fluorophenyl)-1H-indazole-5-carboxamide
CID 77844663
N-(3-chloro-4-fluorophenyl)-1-methylindazole-5-carboxamide
CID 77844718
N-(3,5-dichlorophenyl)-1H-indazole-5-carboxamide
CID 77844662
N-(3,4-dichlorophenyl)-1H-indazole-5-carboxamide
CID 77844601
N-(4-chloro-3-fluorophenyl)-1H-indazole-5-carboxamide
CID 77844664
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-Phenyl-1h-indazole-5-carboxamide
CID 22933429
N-(3,4-difluorophenyl)-1H-indazole-5-carboxamide
CID 77844665
N-(3-chloro-4-fluorophenyl)-2-methylindazole-5-carboxamide
CID 77844719

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide (CID 5146616) is 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide is O=C(Nc1ccc2cn[nH]c2c1)c1c(F)cccc1Cl.
What is the InChIKey of 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide?
The InChIKey is HYVUGTUCERQPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClFN3O/c15-10-2-1-3-11(16)13(10)14(20)18-9-5-4-8-7-17-19-12(8)6-9/h1-7H,(H,17,19)(H,18,20).
What are the key properties of 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide?
2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide has a molecular weight of 289.70 g/mol, XLogP of 3.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-(1H-indazol-6-yl)benzamide is sourced from PubChem (CID 5146616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).