1-(3-chloro-1-methylindazol-7-yl)propan-2-ol

C11H13ClN2O — CID 117322621

IUPAC1-(3-chloro-1-methylindazol-7-yl)propan-2-ol
SMILESCC(O)Cc1cccc2c(Cl)nn(C)c12
InChIInChI=1S/C11H13ClN2O/c1-7(15)6-8-4-3-5-9-10(8)14(2)13-11(9)12/h3-5,7,15H,6H2,1-2H3
InChIKeyZGKIIQHUNJLARA-UHFFFAOYSA-N
MW224.69 g/mol
LogP2.15
Rot. Bonds2

About 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol

1-(3-chloro-1-methylindazol-7-yl)propan-2-ol (PubChem CID 117322621) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol.

Molecular Properties

Compound Name1-(3-chloro-1-methylindazol-7-yl)propan-2-ol
PubChem CID117322621
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC Name1-(3-chloro-1-methylindazol-7-yl)propan-2-ol
SMILESCC(O)Cc1cccc2c(Cl)nn(C)c12
InChIInChI=1S/C11H13ClN2O/c1-7(15)6-8-4-3-5-9-10(8)14(2)13-11(9)12/h3-5,7,15H,6H2,1-2H3
InChIKeyZGKIIQHUNJLARA-UHFFFAOYSA-N
XLogP2.15
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dichlorophenyl)propan-2-ol;methanol
CID 144705964
1-(2-chloro-3-methylphenyl)propan-2-ol
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(E)-3-(3-chloro-1-methylindazol-7-yl)prop-2-en-1-amine
CID 117317346
1-(7-bromo-1-methylindol-3-yl)propan-2-ol
CID 83675918
[3-(3-chloro-1-methylindazol-7-yl)-1,2,4-oxadiazol-5-yl]methanamine
CID 117414013
4-(3-chloro-1-methylindazol-7-yl)-1-methylpyrazol-5-amine
CID 117409154
1-[2-(2,3-dichlorophenyl)phenyl]propan-2-ol
CID 175278361
3-(3-bromo-1-methylindazol-7-yl)propan-1-ol
CID 117425853
1-(3-chloro-1-methylindazol-6-yl)ethanol
CID 84678090
1-(3-bromo-1-methylindazol-7-yl)-N-methylmethanamine
CID 83900931
1-(3-bromo-2-methoxyphenyl)propan-2-ol
CID 83675437
1-[2,3-bis(aminomethyl)phenyl]propan-2-ol
CID 101292367

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol?
The IUPAC name of 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol (CID 117322621) is 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol.
What is the SMILES notation for 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol?
The canonical SMILES for 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol is CC(O)Cc1cccc2c(Cl)nn(C)c12.
What is the InChIKey of 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol?
The InChIKey is ZGKIIQHUNJLARA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c1-7(15)6-8-4-3-5-9-10(8)14(2)13-11(9)12/h3-5,7,15H,6H2,1-2H3.
What are the key properties of 1-(3-chloro-1-methylindazol-7-yl)propan-2-ol?
1-(3-chloro-1-methylindazol-7-yl)propan-2-ol has a molecular weight of 224.69 g/mol, XLogP of 2.15, 2 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-7-yl)propan-2-ol is sourced from PubChem (CID 117322621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).