3-(1-cyclohexylethyl)-1,2-dihydronaphthalene

C18H24 — CID 20793781

IUPAC3-(1-cyclohexylethyl)-1,2-dihydronaphthalene
SMILESCC(C1=Cc2ccccc2CC1)C1CCCCC1
InChIInChI=1S/C18H24/c1-14(15-7-3-2-4-8-15)17-12-11-16-9-5-6-10-18(16)13-17/h5-6,9-10,13-15H,2-4,7-8,11-12H2,1H3
InChIKeyVKTIPSMEBFLPOQ-UHFFFAOYSA-N
MW240.39 g/mol
LogP5.23
Rot. Bonds2

About 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene

3-(1-cyclohexylethyl)-1,2-dihydronaphthalene (PubChem CID 20793781) has the molecular formula C18H24 and a molecular weight of 240.39 g/mol. Its IUPAC name is 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene.

Molecular Properties

Compound Name3-(1-cyclohexylethyl)-1,2-dihydronaphthalene
PubChem CID20793781
Molecular FormulaC18H24
Molecular Weight240.39 g/mol
Exact Mass240.19
IUPAC Name3-(1-cyclohexylethyl)-1,2-dihydronaphthalene
SMILESCC(C1=Cc2ccccc2CC1)C1CCCCC1
InChIInChI=1S/C18H24/c1-14(15-7-3-2-4-8-15)17-12-11-16-9-5-6-10-18(16)13-17/h5-6,9-10,13-15H,2-4,7-8,11-12H2,1H3
InChIKeyVKTIPSMEBFLPOQ-UHFFFAOYSA-N
XLogP5.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.39
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(2-bromoethyl)benzaldehyde;1-cyclohexylethanamine;3-(1-cyclohexylethyl)-1,2-dihydronaphthalene
CID 161337308
4-[4-[(1R)-1-(3,4-dihydronaphthalen-2-yl)ethyl]cyclohexyl]-6-fluoroquinoline
CID 175040529
[(1S)-1-cyclopentylethyl]benzene
CID 102346711
1-cyclobutylethylbenzene
CID 22024745
N-cyclohexyl-3,4-dihydronaphthalene-2-sulfonamide
CID 18190615
2-[(1S)-1-cyclohexylethyl]-3,4-dihydroisoquinolin-2-ium;tetraphenylboranuide
CID 10626711
2-[(1S)-1-cyclohexylethyl]pyridine
CID 130409266
N'-[amino(phenyl)methyl]-1-(3,4-dihydronaphthalen-2-yl)methanediamine
CID 145085051
5-[1-(1H-inden-2-yl)ethyl]-2-methyl-3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1-benzothiophene
CID 153376939
2-propan-2-yl-1H-indene;toluene
CID 161490529
N-[(1R)-1-cycloheptylethyl]-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81390131
benzene;propan-2-ylcyclohexane
CID 163364158

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene?
The IUPAC name of 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene (CID 20793781) is 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene.
What is the SMILES notation for 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene?
The canonical SMILES for 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene is CC(C1=Cc2ccccc2CC1)C1CCCCC1.
What is the InChIKey of 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene?
The InChIKey is VKTIPSMEBFLPOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24/c1-14(15-7-3-2-4-8-15)17-12-11-16-9-5-6-10-18(16)13-17/h5-6,9-10,13-15H,2-4,7-8,11-12H2,1H3.
What are the key properties of 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene?
3-(1-cyclohexylethyl)-1,2-dihydronaphthalene has a molecular weight of 240.39 g/mol, XLogP of 5.23, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclohexylethyl)-1,2-dihydronaphthalene is sourced from PubChem (CID 20793781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).