3-(quinolin-8-ylmethylamino)cyclohexan-1-ol

C16H20N2O — CID 43751062

IUPAC3-(quinolin-8-ylmethylamino)cyclohexan-1-ol
SMILESOC1CCCC(NCc2cccc3cccnc23)C1
InChIInChI=1S/C16H20N2O/c19-15-8-2-7-14(10-15)18-11-13-5-1-4-12-6-3-9-17-16(12)13/h1,3-6,9,14-15,18-19H,2,7-8,10-11H2
InChIKeyCILBNMXOHOFNMZ-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.63
Rot. Bonds3

About 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol

3-(quinolin-8-ylmethylamino)cyclohexan-1-ol (PubChem CID 43751062) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name3-(quinolin-8-ylmethylamino)cyclohexan-1-ol
PubChem CID43751062
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name3-(quinolin-8-ylmethylamino)cyclohexan-1-ol
SMILESOC1CCCC(NCc2cccc3cccnc23)C1
InChIInChI=1S/C16H20N2O/c19-15-8-2-7-14(10-15)18-11-13-5-1-4-12-6-3-9-17-16(12)13/h1,3-6,9,14-15,18-19H,2,7-8,10-11H2
InChIKeyCILBNMXOHOFNMZ-UHFFFAOYSA-N
XLogP2.63
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(quinolin-8-ylmethyl)cyclopentan-1-amine
CID 79032434
4-methyl-N-(quinolin-8-ylmethyl)cycloheptan-1-amine
CID 81426138
3-methylsulfanyl-N-(quinolin-8-ylmethyl)cyclopentan-1-amine
CID 103701386
N-(quinolin-8-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 112728504
2-methyl-N-(quinolin-8-ylmethyl)oxan-4-amine
CID 81428245
1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
CID 43298300
3-[(2,3-dimethylphenyl)methylamino]cyclohexan-1-ol
CID 54983316
2,6-dimethyl-N-(quinolin-8-ylmethyl)piperidin-1-amine
CID 83007197
3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylamino)cyclohexan-1-ol
CID 66414856
trans-(1R,2R)-2-(2-quinolin-8-ylethylamino)cyclopentan-1-ol
CID 102733860
3,3-dimethyl-N-(quinolin-8-ylmethyl)cyclopentan-1-amine
CID 81428857
2-methoxy-N-(quinolin-8-ylmethyl)cyclohexan-1-amine
CID 79032067

Frequently Asked Questions

What is the IUPAC name of 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol?
The IUPAC name of 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol (CID 43751062) is 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol.
What is the SMILES notation for 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol?
The canonical SMILES for 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol is OC1CCCC(NCc2cccc3cccnc23)C1.
What is the InChIKey of 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol?
The InChIKey is CILBNMXOHOFNMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c19-15-8-2-7-14(10-15)18-11-13-5-1-4-12-6-3-9-17-16(12)13/h1,3-6,9,14-15,18-19H,2,7-8,10-11H2.
What are the key properties of 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol?
3-(quinolin-8-ylmethylamino)cyclohexan-1-ol has a molecular weight of 256.35 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(quinolin-8-ylmethylamino)cyclohexan-1-ol is sourced from PubChem (CID 43751062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).