1-(3-chloro-1-methylindazol-6-yl)ethanol

C10H11ClN2O — CID 84678090

IUPAC1-(3-chloro-1-methylindazol-6-yl)ethanol
SMILESCC(O)c1ccc2c(Cl)nn(C)c2c1
InChIInChI=1S/C10H11ClN2O/c1-6(14)7-3-4-8-9(5-7)13(2)12-10(8)11/h3-6,14H,1-2H3
InChIKeyVMUXUKHJWOLNPQ-UHFFFAOYSA-N
MW210.66 g/mol
LogP2.28
Rot. Bonds1

About 1-(3-chloro-1-methylindazol-6-yl)ethanol

1-(3-chloro-1-methylindazol-6-yl)ethanol (PubChem CID 84678090) has the molecular formula C10H11ClN2O and a molecular weight of 210.66 g/mol. Its IUPAC name is 1-(3-chloro-1-methylindazol-6-yl)ethanol.

Molecular Properties

Compound Name1-(3-chloro-1-methylindazol-6-yl)ethanol
PubChem CID84678090
Molecular FormulaC10H11ClN2O
Molecular Weight210.66 g/mol
Exact Mass210.06
IUPAC Name1-(3-chloro-1-methylindazol-6-yl)ethanol
SMILESCC(O)c1ccc2c(Cl)nn(C)c2c1
InChIInChI=1S/C10H11ClN2O/c1-6(14)7-3-4-8-9(5-7)13(2)12-10(8)11/h3-6,14H,1-2H3
InChIKeyVMUXUKHJWOLNPQ-UHFFFAOYSA-N
XLogP2.28
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chloro-1-methylindazol-6-yl)-N-methylethanamine
CID 84725424
1-(9-methylcarbazol-2-yl)ethanol
CID 67359382
1-(1,2,3-trimethylindol-6-yl)ethanol
CID 117291889
2-(3-bromo-1-methylindazol-6-yl)propanoic acid
CID 84730683
3-chloro-6-(isocyanatomethyl)-1-methylindazole
CID 117317274
6-butan-2-yl-1-methyl-3-propan-2-ylindazole
CID 174350260
5-(3-chloro-1-methylindazol-6-yl)-1,2-oxazol-3-amine
CID 117374898
(1R)-1-[3,4-di(propan-2-yl)phenyl]ethanol
CID 125467174
1-(4-amino-3-chlorophenyl)ethanol
CID 126971129
4-(3-chloro-1-methylindazol-6-yl)-1H-pyrazol-5-amine
CID 117372451
5-tert-butyl-3-chloro-1-methylindazole
CID 169058983
1-[3-chloro-4-(3-propan-2-ylpyrazol-1-yl)phenyl]ethanol
CID 55132278

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-1-methylindazol-6-yl)ethanol?
The IUPAC name of 1-(3-chloro-1-methylindazol-6-yl)ethanol (CID 84678090) is 1-(3-chloro-1-methylindazol-6-yl)ethanol.
What is the SMILES notation for 1-(3-chloro-1-methylindazol-6-yl)ethanol?
The canonical SMILES for 1-(3-chloro-1-methylindazol-6-yl)ethanol is CC(O)c1ccc2c(Cl)nn(C)c2c1.
What is the InChIKey of 1-(3-chloro-1-methylindazol-6-yl)ethanol?
The InChIKey is VMUXUKHJWOLNPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O/c1-6(14)7-3-4-8-9(5-7)13(2)12-10(8)11/h3-6,14H,1-2H3.
What are the key properties of 1-(3-chloro-1-methylindazol-6-yl)ethanol?
1-(3-chloro-1-methylindazol-6-yl)ethanol has a molecular weight of 210.66 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-1-methylindazol-6-yl)ethanol is sourced from PubChem (CID 84678090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).