8-(3-methylcyclohexyl)oxyquinolin-2-amine

C16H20N2O — CID 10038053

IUPAC8-(3-methylcyclohexyl)oxyquinolin-2-amine
SMILESCC1CCCC(Oc2cccc3ccc(N)nc23)C1
InChIInChI=1S/C16H20N2O/c1-11-4-2-6-13(10-11)19-14-7-3-5-12-8-9-15(17)18-16(12)14/h3,5,7-9,11,13H,2,4,6,10H2,1H3,(H2,17,18)
InChIKeyAZGLOGDXDJFQFK-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.77
Rot. Bonds2

About 8-(3-methylcyclohexyl)oxyquinolin-2-amine

8-(3-methylcyclohexyl)oxyquinolin-2-amine (PubChem CID 10038053) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 8-(3-methylcyclohexyl)oxyquinolin-2-amine.

Molecular Properties

Compound Name8-(3-methylcyclohexyl)oxyquinolin-2-amine
PubChem CID10038053
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name8-(3-methylcyclohexyl)oxyquinolin-2-amine
SMILESCC1CCCC(Oc2cccc3ccc(N)nc23)C1
InChIInChI=1S/C16H20N2O/c1-11-4-2-6-13(10-11)19-14-7-3-5-12-8-9-15(17)18-16(12)14/h3,5,7-9,11,13H,2,4,6,10H2,1H3,(H2,17,18)
InChIKeyAZGLOGDXDJFQFK-UHFFFAOYSA-N
XLogP3.77
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(3-methylcyclohexyl)oxyquinolin-2-amine?
The IUPAC name of 8-(3-methylcyclohexyl)oxyquinolin-2-amine (CID 10038053) is 8-(3-methylcyclohexyl)oxyquinolin-2-amine.
What is the SMILES notation for 8-(3-methylcyclohexyl)oxyquinolin-2-amine?
The canonical SMILES for 8-(3-methylcyclohexyl)oxyquinolin-2-amine is CC1CCCC(Oc2cccc3ccc(N)nc23)C1.
What is the InChIKey of 8-(3-methylcyclohexyl)oxyquinolin-2-amine?
The InChIKey is AZGLOGDXDJFQFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11-4-2-6-13(10-11)19-14-7-3-5-12-8-9-15(17)18-16(12)14/h3,5,7-9,11,13H,2,4,6,10H2,1H3,(H2,17,18).
What are the key properties of 8-(3-methylcyclohexyl)oxyquinolin-2-amine?
8-(3-methylcyclohexyl)oxyquinolin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methylcyclohexyl)oxyquinolin-2-amine is sourced from PubChem (CID 10038053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).