7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole

C11H13FN2O — CID 142719046

IUPAC7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole
SMILESCOc1ccc(F)c2n[nH]c(C(C)C)c12
InChIInChI=1S/C11H13FN2O/c1-6(2)10-9-8(15-3)5-4-7(12)11(9)14-13-10/h4-6H,1-3H3,(H,13,14)
InChIKeyGUJBGDQZFRDYKJ-UHFFFAOYSA-N
MW208.24 g/mol
LogP2.83
Rot. Bonds2

About 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole

7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole (PubChem CID 142719046) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole.

Molecular Properties

Compound Name7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole
PubChem CID142719046
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC Name7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole
SMILESCOc1ccc(F)c2n[nH]c(C(C)C)c12
InChIInChI=1S/C11H13FN2O/c1-6(2)10-9-8(15-3)5-4-7(12)11(9)14-13-10/h4-6H,1-3H3,(H,13,14)
InChIKeyGUJBGDQZFRDYKJ-UHFFFAOYSA-N
XLogP2.83
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-7-methyl-3-propan-2-yl-2H-indazole
CID 118119319
2-bromo-8-fluoro-5-methoxyquinoline
CID 102941272
1,4,5,8-tetramethoxynaphthalene
CID 10220551
8-fluoro-5-methoxyquinoline-4-carbaldehyde
CID 172633663
7-fluoro-3,6-di(propan-2-yl)-2H-indazole
CID 165010625
1-(7-methoxy-2H-indazol-3-yl)ethanamine
CID 112714941
3,4-dibromo-7-methoxy-2H-indazole
CID 114589251
4-chloro-5,8-dimethoxy-2-methyl-3-propan-2-ylquinoline
CID 55186942
2-(7-fluoro-4-methoxy-1H-indazol-3-yl)isoindole-1,3-dione
CID 58054480
1-(2,6-difluoro-3-methoxyphenyl)ethanamine
CID 55272050
1-(2,3-difluoro-6-methoxyphenyl)ethanol
CID 58022414
3-(3-fluoro-4-methoxyphenyl)-1H-pyridazine-6-thione
CID 82083568

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?
The IUPAC name of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole (CID 142719046) is 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole.
What is the SMILES notation for 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?
The canonical SMILES for 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole is COc1ccc(F)c2n[nH]c(C(C)C)c12.
What is the InChIKey of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?
The InChIKey is GUJBGDQZFRDYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c1-6(2)10-9-8(15-3)5-4-7(12)11(9)14-13-10/h4-6H,1-3H3,(H,13,14).
What are the key properties of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?
7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole has a molecular weight of 208.24 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole is sourced from PubChem (CID 142719046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).