6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline

C13H17N — CID 170444076

IUPAC6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline
SMILESC=Cc1ccc2c(c1)CCCN2CC
InChIInChI=1S/C13H17N/c1-3-11-7-8-13-12(10-11)6-5-9-14(13)4-2/h3,7-8,10H,1,4-6,9H2,2H3
InChIKeyGSRHYEUJUUPWJS-UHFFFAOYSA-N
MW187.29 g/mol
LogP3.10
Rot. Bonds2

About 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline

6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline (PubChem CID 170444076) has the molecular formula C13H17N and a molecular weight of 187.29 g/mol. Its IUPAC name is 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline
PubChem CID170444076
Molecular FormulaC13H17N
Molecular Weight187.29 g/mol
Exact Mass187.14
IUPAC Name6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline
SMILESC=Cc1ccc2c(c1)CCCN2CC
InChIInChI=1S/C13H17N/c1-3-11-7-8-13-12(10-11)6-5-9-14(13)4-2/h3,7-8,10H,1,4-6,9H2,2H3
InChIKeyGSRHYEUJUUPWJS-UHFFFAOYSA-N
XLogP3.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}

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Related Compounds

N-(4-ethenylphenyl)sulfanyl-1-(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methanamine
CID 171488399
ethane;1-ethyl-6-methyl-3,4-dihydro-2H-quinoline
CID 143643901
1-(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)propan-1-one
CID 39104414
1-ethyl-6-(trifluoromethoxy)-3,4-dihydro-2H-quinoline
CID 129301440
1-ethyl-2,3,4,6-tetrahydrocyclopropa[g]quinoline
CID 164919435
1-[(Z)-(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methylideneamino]-3-(3-methylphenyl)thiourea
CID 6109074
1-ethyl-6-(5-methyl-1H-pyrazol-3-yl)-3,4-dihydro-2H-quinoline
CID 130440298
1-(3-chlorophenyl)-3-[(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methylideneamino]thiourea
CID 4112377
1-(2-chloro-4-methylphenyl)-3-[(E)-(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methylideneamino]thiourea
CID 46372565
1-cyclohexyl-5-ethenyl-2,3-dihydroindole
CID 66772198
4-[3-(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)propyl]morpholine
CID 170870224
2-(1-ethyl-2,3-dihydroindol-5-yl)propan-2-amine
CID 115114838

Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline?
The IUPAC name of 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline (CID 170444076) is 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline?
The canonical SMILES for 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline is C=Cc1ccc2c(c1)CCCN2CC.
What is the InChIKey of 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline?
The InChIKey is GSRHYEUJUUPWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N/c1-3-11-7-8-13-12(10-11)6-5-9-14(13)4-2/h3,7-8,10H,1,4-6,9H2,2H3.
What are the key properties of 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline?
6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline has a molecular weight of 187.29 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-1-ethyl-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 170444076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).