1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine

C19H27N — CID 174880819

IUPAC1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine
SMILESCC1C(C)C(C)(C)C(C)(C)C2=c3ccccc3=CCN21
InChIInChI=1S/C19H27N/c1-13-14(2)20-12-11-15-9-7-8-10-16(15)17(20)19(5,6)18(13,3)4/h7-11,13-14H,12H2,1-6H3
InChIKeyUQGIIMLXYDHQRF-UHFFFAOYSA-N
MW269.43 g/mol
LogP2.98
Rot. Bonds

About 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine

1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine (PubChem CID 174880819) has the molecular formula C19H27N and a molecular weight of 269.43 g/mol. Its IUPAC name is 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine.

Molecular Properties

Compound Name1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine
PubChem CID174880819
Molecular FormulaC19H27N
Molecular Weight269.43 g/mol
Exact Mass269.21
IUPAC Name1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine
SMILESCC1C(C)C(C)(C)C(C)(C)C2=c3ccccc3=CCN21
InChIInChI=1S/C19H27N/c1-13-14(2)20-12-11-15-9-7-8-10-16(15)17(20)19(5,6)18(13,3)4/h7-11,13-14H,12H2,1-6H3
InChIKeyUQGIIMLXYDHQRF-UHFFFAOYSA-N
XLogP2.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine?
The IUPAC name of 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine (CID 174880819) is 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine.
What is the SMILES notation for 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine?
The canonical SMILES for 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine is CC1C(C)C(C)(C)C(C)(C)C2=c3ccccc3=CCN21.
What is the InChIKey of 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine?
The InChIKey is UQGIIMLXYDHQRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N/c1-13-14(2)20-12-11-15-9-7-8-10-16(15)17(20)19(5,6)18(13,3)4/h7-11,13-14H,12H2,1-6H3.
What are the key properties of 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine?
1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine has a molecular weight of 269.43 g/mol, XLogP of 2.98, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3,4-hexamethyl-4,6-dihydro-3H-benzo[a]quinolizine is sourced from PubChem (CID 174880819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).