4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline

C16H22N2 — CID 144782316

IUPAC4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline
SMILESCCC1C2N(C)C=CN2c2ccccc2C1(C)C
InChIInChI=1S/C16H22N2/c1-5-12-15-17(4)10-11-18(15)14-9-7-6-8-13(14)16(12,2)3/h6-12,15H,5H2,1-4H3
InChIKeyDGKLXWKADDHCII-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.55
Rot. Bonds1

About 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline

4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline (PubChem CID 144782316) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline.

Molecular Properties

Compound Name4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline
PubChem CID144782316
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline
SMILESCCC1C2N(C)C=CN2c2ccccc2C1(C)C
InChIInChI=1S/C16H22N2/c1-5-12-15-17(4)10-11-18(15)14-9-7-6-8-13(14)16(12,2)3/h6-12,15H,5H2,1-4H3
InChIKeyDGKLXWKADDHCII-UHFFFAOYSA-N
XLogP3.55
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4,5,5-tetramethyl-3a,4-dihydroimidazo[1,2-a]quinoline
CID 144782356
4,5-diethyl-3-methyl-4,5-dihydro-3aH-imidazo[1,2-a]quinoline
CID 145072065
2,18-diethyl-1,2,4,16,18-pentamethyl-4,7,13,16-tetrazapentacyclo[10.6.1.03,7.08,19.013,17]nonadeca-5,8(19),9,11,14-pentaene
CID 123333403
1,3,15,17-tetramethyl-3,6,12,15-tetrazapentacyclo[9.6.1.02,6.07,18.012,16]octadeca-4,7,9,11(18),13-pentaene
CID 129254186
2-(1,3,3-trimethyl-2H-indol-2-yl)acetonitrile
CID 67262655
1,4,4-trimethyl-3-(2-methylbutyl)-2,3-dihydroquinoline
CID 137429120
2,4,16,18-tetramethyl-4,7,13,16-tetrazahexacyclo[10.6.1.02,18.03,7.08,19.013,17]nonadeca-5,8(19),9,11,14-pentaene
CID 130458154
2,3,3-trimethyl-1-propyl-1,2-dihydroindol-1-ium
CID 59449433
9,9,10-trimethylacridine
CID 610451
1,3-bis(1-butyl-3,3-dimethyl-2H-indol-2-yl)propan-2-one
CID 59773729
8,9-diethyl-8-methyl-11-phenyl-1,11,13,16-tetrazatetracyclo[8.7.0.02,7.012,17]heptadeca-2,4,6,12,14,16-hexaene
CID 123285328
4,4-dimethyl-3-phenyl-2,3a-dihydro-1H-imidazo[1,2-a]indole
CID 130368704

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline?
The IUPAC name of 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline (CID 144782316) is 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline.
What is the SMILES notation for 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline?
The canonical SMILES for 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline is CCC1C2N(C)C=CN2c2ccccc2C1(C)C.
What is the InChIKey of 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline?
The InChIKey is DGKLXWKADDHCII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-5-12-15-17(4)10-11-18(15)14-9-7-6-8-13(14)16(12,2)3/h6-12,15H,5H2,1-4H3.
What are the key properties of 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline?
4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline has a molecular weight of 242.37 g/mol, XLogP of 3.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,5,5-trimethyl-3a,4-dihydroimidazo[1,2-a]quinoline is sourced from PubChem (CID 144782316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).