1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol

C17H25NO — CID 114794993

IUPAC1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol
SMILESCC(O)(C1CCCCC1)C1CCc2ccccc2N1
InChIInChI=1S/C17H25NO/c1-17(19,14-8-3-2-4-9-14)16-12-11-13-7-5-6-10-15(13)18-16/h5-7,10,14,16,18-19H,2-4,8-9,11-12H2,1H3
InChIKeyDCVYNPCGWDCBNA-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.74
Rot. Bonds2

About 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol

1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol (PubChem CID 114794993) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol.

Molecular Properties

Compound Name1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol
PubChem CID114794993
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol
SMILESCC(O)(C1CCCCC1)C1CCc2ccccc2N1
InChIInChI=1S/C17H25NO/c1-17(19,14-8-3-2-4-9-14)16-12-11-13-7-5-6-10-15(13)18-16/h5-7,10,14,16,18-19H,2-4,8-9,11-12H2,1H3
InChIKeyDCVYNPCGWDCBNA-UHFFFAOYSA-N
XLogP3.74
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,3-dimethyl-2-(1,2,3,4-tetrahydroquinolin-2-yl)butan-2-ol
CID 115401133
1-(methylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol
CID 66037691
3-(1,2,3,4-tetrahydroquinolin-2-yl)hexan-3-ol
CID 114079972
4-[1-hydroxy-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethyl]phenol
CID 83076109
1-methoxy-2-(1,2,3,4-tetrahydroquinolin-2-yl)butan-2-ol
CID 65042148
4-(tert-butylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)butan-2-ol
CID 66001867
2-(2,3-dihydro-1H-indol-2-yl)propan-2-ol
CID 14668660
1-(2-methylpropylamino)-2-(1,2,3,4-tetrahydroquinolin-2-yl)propan-2-ol
CID 66038474
2-(2,3-dihydro-1H-indol-2-yl)-3-methylbutan-2-ol
CID 65042828
2,2-dimethyl-3-(1,2,3,4-tetrahydroquinolin-2-yloxy)propan-1-ol
CID 81216858
2,2-dimethyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)propan-1-ol
CID 65041637
2-methyl-1,2,3,4-tetrahydroquinoline;titanium
CID 158265975

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
The IUPAC name of 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol (CID 114794993) is 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol.
What is the SMILES notation for 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
The canonical SMILES for 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol is CC(O)(C1CCCCC1)C1CCc2ccccc2N1.
What is the InChIKey of 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
The InChIKey is DCVYNPCGWDCBNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-17(19,14-8-3-2-4-9-14)16-12-11-13-7-5-6-10-15(13)18-16/h5-7,10,14,16,18-19H,2-4,8-9,11-12H2,1H3.
What are the key properties of 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol?
1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol has a molecular weight of 259.39 g/mol, XLogP of 3.74, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol is sourced from PubChem (CID 114794993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).