6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine

C16H25N — CID 130378535

IUPAC6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine
SMILESC=C1CCCN2C1=C(C(C)C)C(C)=CC2(C)C
InChIInChI=1S/C16H25N/c1-11(2)14-13(4)10-16(5,6)17-9-7-8-12(3)15(14)17/h10-11H,3,7-9H2,1-2,4-6H3
InChIKeyRRUMETFYNYJMTI-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.29
Rot. Bonds1

About 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine

6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine (PubChem CID 130378535) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine.

Molecular Properties

Compound Name6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine
PubChem CID130378535
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine
SMILESC=C1CCCN2C1=C(C(C)C)C(C)=CC2(C)C
InChIInChI=1S/C16H25N/c1-11(2)14-13(4)10-16(5,6)17-9-7-8-12(3)15(14)17/h10-11H,3,7-9H2,1-2,4-6H3
InChIKeyRRUMETFYNYJMTI-UHFFFAOYSA-N
XLogP4.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine?
The IUPAC name of 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine (CID 130378535) is 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine.
What is the SMILES notation for 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine?
The canonical SMILES for 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine is C=C1CCCN2C1=C(C(C)C)C(C)=CC2(C)C.
What is the InChIKey of 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine?
The InChIKey is RRUMETFYNYJMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-11(2)14-13(4)10-16(5,6)17-9-7-8-12(3)15(14)17/h10-11H,3,7-9H2,1-2,4-6H3.
What are the key properties of 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine?
6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine has a molecular weight of 231.38 g/mol, XLogP of 4.29, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,8-trimethyl-1-methylidene-9-propan-2-yl-3,4-dihydro-2H-quinolizine is sourced from PubChem (CID 130378535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).