cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol

C18H23NO2 — CID 59474826

IUPACcyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol
SMILESCOc1nc2cc(C(O)C3CCCCC3)ccc2cc1C
InChIInChI=1S/C18H23NO2/c1-12-10-14-8-9-15(11-16(14)19-18(12)21-2)17(20)13-6-4-3-5-7-13/h8-11,13,17,20H,3-7H2,1-2H3
InChIKeyQQSRQJOKYMMCSN-UHFFFAOYSA-N
MW285.39 g/mol
LogP4.17
Rot. Bonds3

About cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol

cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol (PubChem CID 59474826) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol.

Molecular Properties

Compound Namecyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol
PubChem CID59474826
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Namecyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol
SMILESCOc1nc2cc(C(O)C3CCCCC3)ccc2cc1C
InChIInChI=1S/C18H23NO2/c1-12-10-14-8-9-15(11-16(14)19-18(12)21-2)17(20)13-6-4-3-5-7-13/h8-11,13,17,20H,3-7H2,1-2H3
InChIKeyQQSRQJOKYMMCSN-UHFFFAOYSA-N
XLogP4.17
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cycloheptyl(quinolin-7-yl)methanol
CID 81216722
(3-chloro-4-methoxyphenyl)-cycloheptylmethanol
CID 62590019
cycloheptyl-(4-fluoro-3-methoxyphenyl)methanol
CID 115829463
cyclopentyl-(4-fluoro-3-methylphenyl)methanol
CID 60929105
(4-chloro-3-methoxyphenyl)-cyclopentylmethanol
CID 79699326
cyclooctyl-(3,4-dichlorophenyl)methanol
CID 65023087
cyclopentyl(naphthalen-2-yl)methanol
CID 62715022
cyclohexyl-(3,4,5-trimethoxyphenyl)methanol
CID 63895814
cycloheptyl-(3,5-dimethylphenyl)methanol
CID 65399155
(S)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184621
(R)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184618
cyclooctyl(5,6,7,8-tetrahydronaphthalen-2-yl)methanol
CID 65023370

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol?
The IUPAC name of cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol (CID 59474826) is cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol.
What is the SMILES notation for cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol?
The canonical SMILES for cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol is COc1nc2cc(C(O)C3CCCCC3)ccc2cc1C.
What is the InChIKey of cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol?
The InChIKey is QQSRQJOKYMMCSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-12-10-14-8-9-15(11-16(14)19-18(12)21-2)17(20)13-6-4-3-5-7-13/h8-11,13,17,20H,3-7H2,1-2H3.
What are the key properties of cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol?
cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol has a molecular weight of 285.39 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(2-methoxy-3-methylquinolin-7-yl)methanol is sourced from PubChem (CID 59474826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).