(5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol

C11H13FN2O — CID 176566685

IUPAC(5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol
SMILESCCc1cc2cn(C)nc2c(F)c1CO
InChIInChI=1S/C11H13FN2O/c1-3-7-4-8-5-14(2)13-11(8)10(12)9(7)6-15/h4-5,15H,3,6H2,1-2H3
InChIKeyUGSMNDDHNYDGPS-UHFFFAOYSA-N
MW208.24 g/mol
LogP1.77
Rot. Bonds2

About (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol

(5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol (PubChem CID 176566685) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol.

Molecular Properties

Compound Name(5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol
PubChem CID176566685
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC Name(5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol
SMILESCCc1cc2cn(C)nc2c(F)c1CO
InChIInChI=1S/C11H13FN2O/c1-3-7-4-8-5-14(2)13-11(8)10(12)9(7)6-15/h4-5,15H,3,6H2,1-2H3
InChIKeyUGSMNDDHNYDGPS-UHFFFAOYSA-N
XLogP1.77
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol?
The IUPAC name of (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol (CID 176566685) is (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol.
What is the SMILES notation for (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol?
The canonical SMILES for (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol is CCc1cc2cn(C)nc2c(F)c1CO.
What is the InChIKey of (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol?
The InChIKey is UGSMNDDHNYDGPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c1-3-7-4-8-5-14(2)13-11(8)10(12)9(7)6-15/h4-5,15H,3,6H2,1-2H3.
What are the key properties of (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol?
(5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol has a molecular weight of 208.24 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-7-fluoro-2-methylindazol-6-yl)methanol is sourced from PubChem (CID 176566685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).