4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol

C14H27NO — CID 610792

IUPAC4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol
SMILESCCC1(O)CC(C)N(C)C2CC(C)CCC21
InChIInChI=1S/C14H27NO/c1-5-14(16)9-11(3)15(4)13-8-10(2)6-7-12(13)14/h10-13,16H,5-9H2,1-4H3
InChIKeyNFOYSWRSDAMZTH-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.66
Rot. Bonds1

About 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol

4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol (PubChem CID 610792) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol.

Molecular Properties

Compound Name4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol
PubChem CID610792
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol
SMILESCCC1(O)CC(C)N(C)C2CC(C)CCC21
InChIInChI=1S/C14H27NO/c1-5-14(16)9-11(3)15(4)13-8-10(2)6-7-12(13)14/h10-13,16H,5-9H2,1-4H3
InChIKeyNFOYSWRSDAMZTH-UHFFFAOYSA-N
XLogP2.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol with MolForge

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Launch Full Analysis

Related Compounds

1,4-Dimethyldecahydroquinolin-4-ol
CID 4038309
4-Ethynyl-1,2-dimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol
CID 139830
4-Quinolinol, 4-ethyldecahydro-1,2-dimethyl-, (2alpha,4beta,4aalpha,8abeta)-
CID 140686
1-Ethyl-4-ethynyl-2-methyldecahydro-4-quinolinol
CID 142275
4-Cyclohexyl-1-methylpiperid-4-ol
CID 115390
2-[(1R,9aR)-5-methyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-5-ium-1-yl]propan-2-ol
CID 11875389
4-Ethynyl-1-methyldecahydro-4-quinolinol
CID 591707
1-Ethyl-4-ethynyldecahydro-4-quinolinol
CID 596468
2-Methyl-4-butyldecahydro-4-quinolinol
CID 597872
1,2-Dimethyl-4-butyldecahydro-4-quinolol
CID 602872
4-Ethynyl-1,2,7-trimethyl-trans-decahydroquinol-4-ol
CID 609846
4-Ethyl-1,2-dimethyl-7-tert-butyl-trans-decahydroquinolin-4-ol
CID 619905

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol?
The IUPAC name of 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol (CID 610792) is 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol.
What is the SMILES notation for 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol?
The canonical SMILES for 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol is CCC1(O)CC(C)N(C)C2CC(C)CCC21.
What is the InChIKey of 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol?
The InChIKey is NFOYSWRSDAMZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-5-14(16)9-11(3)15(4)13-8-10(2)6-7-12(13)14/h10-13,16H,5-9H2,1-4H3.
What are the key properties of 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol?
4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol has a molecular weight of 225.38 g/mol, XLogP of 2.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,2,7-trimethyl-2,3,4a,5,6,7,8,8a-octahydroquinolin-4-ol is sourced from PubChem (CID 610792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).