2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol

C18H23NO — CID 81216498

IUPAC2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
SMILESCc1ccc2cc(C3(O)CCC(C)CC3C)ccc2n1
InChIInChI=1S/C18H23NO/c1-12-8-9-18(20,13(2)10-12)16-6-7-17-15(11-16)5-4-14(3)19-17/h4-7,11-13,20H,8-10H2,1-3H3
InChIKeyBHDKEJJHTNUNFE-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.19
Rot. Bonds1

About 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol

2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol (PubChem CID 81216498) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
PubChem CID81216498
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC Name2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
SMILESCc1ccc2cc(C3(O)CCC(C)CC3C)ccc2n1
InChIInChI=1S/C18H23NO/c1-12-8-9-18(20,13(2)10-12)16-6-7-17-15(11-16)5-4-14(3)19-17/h4-7,11-13,20H,8-10H2,1-3H3
InChIKeyBHDKEJJHTNUNFE-UHFFFAOYSA-N
XLogP4.19
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 81304523
2,3-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 81216138
3,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 81215757
4-amino-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 81216154
1-(3,4-dimethoxyphenyl)-2,4-dimethylcyclohexan-1-ol
CID 64756637
2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine
CID 81216311
3-methoxy-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 106873976
(1S,2R,4R)-2,4-dimethyl-1-phenylcyclohexan-1-ol
CID 124508976
1-(3-fluorophenyl)-2,4-dimethylcyclohexan-1-ol
CID 64756021
1-(2-methylquinolin-6-yl)-4-propylcyclohexan-1-ol
CID 81197781
1-methyl-4-(2-methylquinolin-6-yl)piperidin-4-ol
CID 56750238
1,5-dimethyl-3-(2-methylquinolin-6-yl)pyrrolidin-3-ol
CID 81467927

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
The IUPAC name of 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol (CID 81216498) is 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol.
What is the SMILES notation for 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
The canonical SMILES for 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol is Cc1ccc2cc(C3(O)CCC(C)CC3C)ccc2n1.
What is the InChIKey of 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
The InChIKey is BHDKEJJHTNUNFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-12-8-9-18(20,13(2)10-12)16-6-7-17-15(11-16)5-4-14(3)19-17/h4-7,11-13,20H,8-10H2,1-3H3.
What are the key properties of 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol has a molecular weight of 269.39 g/mol, XLogP of 4.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol is sourced from PubChem (CID 81216498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).