6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine

C15H21N3O — CID 170092685

IUPAC6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine
SMILESCOc1cc2nn(C3CCC(C)CC3)cc2cc1N
InChIInChI=1S/C15H21N3O/c1-10-3-5-12(6-4-10)18-9-11-7-13(16)15(19-2)8-14(11)17-18/h7-10,12H,3-6,16H2,1-2H3
InChIKeyBUJRVRFDMGOQEW-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.38
Rot. Bonds2

About 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine

6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine (PubChem CID 170092685) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine.

Molecular Properties

Compound Name6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine
PubChem CID170092685
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine
SMILESCOc1cc2nn(C3CCC(C)CC3)cc2cc1N
InChIInChI=1S/C15H21N3O/c1-10-3-5-12(6-4-10)18-9-11-7-13(16)15(19-2)8-14(11)17-18/h7-10,12H,3-6,16H2,1-2H3
InChIKeyBUJRVRFDMGOQEW-UHFFFAOYSA-N
XLogP3.38
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine?
The IUPAC name of 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine (CID 170092685) is 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine.
What is the SMILES notation for 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine?
The canonical SMILES for 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine is COc1cc2nn(C3CCC(C)CC3)cc2cc1N.
What is the InChIKey of 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine?
The InChIKey is BUJRVRFDMGOQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-10-3-5-12(6-4-10)18-9-11-7-13(16)15(19-2)8-14(11)17-18/h7-10,12H,3-6,16H2,1-2H3.
What are the key properties of 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine?
6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine has a molecular weight of 259.35 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(4-methylcyclohexyl)indazol-5-amine is sourced from PubChem (CID 170092685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).