6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline

C17H25N — CID 114192887

IUPAC6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline
SMILESc1cc2c(cc1CCC1CCCCC1)CCCN2
InChIInChI=1S/C17H25N/c1-2-5-14(6-3-1)8-9-15-10-11-17-16(13-15)7-4-12-18-17/h10-11,13-14,18H,1-9,12H2
InChIKeyBKHPBSGOIDTKKB-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.56
Rot. Bonds3

About 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline

6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 114192887) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline
PubChem CID114192887
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC Name6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline
SMILESc1cc2c(cc1CCC1CCCCC1)CCCN2
InChIInChI=1S/C17H25N/c1-2-5-14(6-3-1)8-9-15-10-11-17-16(13-15)7-4-12-18-17/h10-11,13-14,18H,1-9,12H2
InChIKeyBKHPBSGOIDTKKB-UHFFFAOYSA-N
XLogP4.56
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline
CID 116997911
5-(2-piperidin-4-ylethyl)-2,3-dihydro-1H-indole
CID 116998012
6-(cyclobutylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106779249
N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cycloheptanamine
CID 82256808
6-(3,3-dimethylbutyl)-1,2,3,4-tetrahydroquinoline
CID 106778864
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cycloheptanamine
CID 61151262
N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine
CID 82256847
6-[2-(4-methylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968254
1-cyclobutyl-N-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)methanamine
CID 62861548
3-cyclopentyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide
CID 62632415
4-(1,2,3,4-tetrahydroquinolin-6-yl)butanal
CID 164919422
6-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 28776156

Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline (CID 114192887) is 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline is c1cc2c(cc1CCC1CCCCC1)CCCN2.
What is the InChIKey of 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is BKHPBSGOIDTKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-2-5-14(6-3-1)8-9-15-10-11-17-16(13-15)7-4-12-18-17/h10-11,13-14,18H,1-9,12H2.
What are the key properties of 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline?
6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 243.39 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 114192887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).