8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine

C19H31N — CID 58291547

IUPAC8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine
SMILESCCC1=CC(C)(C)N2CCCC(=C(C)C)C2=C1C(C)C
InChIInChI=1S/C19H31N/c1-8-15-12-19(6,7)20-11-9-10-16(13(2)3)18(20)17(15)14(4)5/h12,14H,8-11H2,1-7H3
InChIKeyRGPMOWHJGHWTCM-UHFFFAOYSA-N
MW273.46 g/mol
LogP5.46
Rot. Bonds2

About 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine

8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine (PubChem CID 58291547) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine.

Molecular Properties

Compound Name8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine
PubChem CID58291547
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC Name8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine
SMILESCCC1=CC(C)(C)N2CCCC(=C(C)C)C2=C1C(C)C
InChIInChI=1S/C19H31N/c1-8-15-12-19(6,7)20-11-9-10-16(13(2)3)18(20)17(15)14(4)5/h12,14H,8-11H2,1-7H3
InChIKeyRGPMOWHJGHWTCM-UHFFFAOYSA-N
XLogP5.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.46
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine with MolForge

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Related Compounds

1-((r,s)-6-Methyl-cyclohex-1-enyl)-piperidine
CID 15514600
N-allyltetrahydroquinoline
CID 69120580
N-Methyl-tetrahydrochinolin
CID 69139421
N-butyltetrahydroquinoline
CID 70628816
1-(2-fluoropropan-2-yl)-3-[[(3S)-3-methylpiperidin-1-yl]methyl]-6,7,8,9-tetrahydropyrido[1,2-a]azepine
CID 174271096
1-(2-Fluoro-3,6-dimethylcyclohexa-1,5-dien-1-yl)piperidine
CID 176552867
1-methyl-2,3,4,6,7,8-hexahydro-1H-quinolizine
CID 12288033
Methyloctahydrobenzoquinoline
CID 85532089
Methyloctahydrodibenzoquinoline
CID 129724108
Methylhexahydrodibenzoquinoline
CID 129724124
1-ethyl-2,3,4,6,7,8-hexahydro-1H-quinolizine
CID 134894503
1-(3-Methylcyclohexen-1-yl)piperidine
CID 13184321

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine?
The IUPAC name of 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine (CID 58291547) is 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine.
What is the SMILES notation for 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine?
The canonical SMILES for 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine is CCC1=CC(C)(C)N2CCCC(=C(C)C)C2=C1C(C)C.
What is the InChIKey of 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine?
The InChIKey is RGPMOWHJGHWTCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-8-15-12-19(6,7)20-11-9-10-16(13(2)3)18(20)17(15)14(4)5/h12,14H,8-11H2,1-7H3.
What are the key properties of 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine?
8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine has a molecular weight of 273.46 g/mol, XLogP of 5.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-6,6-dimethyl-9-propan-2-yl-1-propan-2-ylidene-3,4-dihydro-2H-quinolizine is sourced from PubChem (CID 58291547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).