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

C19H25NO — CID 81304523

IUPAC2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
SMILESCc1ccc2cc(C3(O)CCC(C)(C)CC3C)ccc2n1
InChIInChI=1S/C19H25NO/c1-13-12-18(3,4)9-10-19(13,21)16-7-8-17-15(11-16)6-5-14(2)20-17/h5-8,11,13,21H,9-10,12H2,1-4H3
InChIKeyDHPOJDZCVOYPCI-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.58
Rot. Bonds1

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

2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol (PubChem CID 81304523) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
PubChem CID81304523
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
SMILESCc1ccc2cc(C3(O)CCC(C)(C)CC3C)ccc2n1
InChIInChI=1S/C19H25NO/c1-13-12-18(3,4)9-10-19(13,21)16-7-8-17-15(11-16)6-5-14(2)20-17/h5-8,11,13,21H,9-10,12H2,1-4H3
InChIKeyDHPOJDZCVOYPCI-UHFFFAOYSA-N
XLogP4.58
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 81216498
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
3-methoxy-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 106873976
4-amino-1-(2-methylquinolin-6-yl)cyclohexan-1-ol
CID 81216154
1,5-dimethyl-3-(2-methylquinolin-6-yl)pyrrolidin-3-ol
CID 81467927
1-(4-tert-butylphenyl)-2,4,4-trimethylcyclohexan-1-ol
CID 81313765
1-methyl-4-(2-methylquinolin-6-yl)piperidin-4-ol
CID 56750238
2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine
CID 81216311
2,4,4-trimethyl-1-naphthalen-2-ylcyclopentan-1-ol
CID 106663884
1-(2-methylquinolin-6-yl)-4-propylcyclohexan-1-ol
CID 81197781
1-(2,4-dimethylphenyl)-2,4,4-trimethylcyclohexan-1-ol
CID 81314579

Frequently Asked Questions

What is the IUPAC name of 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
The IUPAC name of 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol (CID 81304523) is 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol.
What is the SMILES notation for 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
The canonical SMILES for 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol is Cc1ccc2cc(C3(O)CCC(C)(C)CC3C)ccc2n1.
What is the InChIKey of 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
The InChIKey is DHPOJDZCVOYPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13-12-18(3,4)9-10-19(13,21)16-7-8-17-15(11-16)6-5-14(2)20-17/h5-8,11,13,21H,9-10,12H2,1-4H3.
What are the key properties of 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol?
2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol has a molecular weight of 283.42 g/mol, XLogP of 4.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,4-trimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-ol is sourced from PubChem (CID 81304523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).