7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine

C19H21N — CID 13203000

IUPAC7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine
SMILESc1ccc(C2CN3CCCCC3c3ccccc32)cc1
InChIInChI=1S/C19H21N/c1-2-8-15(9-3-1)18-14-20-13-7-6-12-19(20)17-11-5-4-10-16(17)18/h1-5,8-11,18-19H,6-7,12-14H2
InChIKeyRDHQAERKGRHFCB-UHFFFAOYSA-N
MW263.38 g/mol
LogP4.36
Rot. Bonds1

About 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine

7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine (PubChem CID 13203000) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine.

Molecular Properties

Compound Name7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine
PubChem CID13203000
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC Name7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine
SMILESc1ccc(C2CN3CCCCC3c3ccccc32)cc1
InChIInChI=1S/C19H21N/c1-2-8-15(9-3-1)18-14-20-13-7-6-12-19(20)17-11-5-4-10-16(17)18/h1-5,8-11,18-19H,6-7,12-14H2
InChIKeyRDHQAERKGRHFCB-UHFFFAOYSA-N
XLogP4.36
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine?
The IUPAC name of 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine (CID 13203000) is 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine.
What is the SMILES notation for 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine?
The canonical SMILES for 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine is c1ccc(C2CN3CCCCC3c3ccccc32)cc1.
What is the InChIKey of 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine?
The InChIKey is RDHQAERKGRHFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N/c1-2-8-15(9-3-1)18-14-20-13-7-6-12-19(20)17-11-5-4-10-16(17)18/h1-5,8-11,18-19H,6-7,12-14H2.
What are the key properties of 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine?
7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine has a molecular weight of 263.38 g/mol, XLogP of 4.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine is sourced from PubChem (CID 13203000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).