1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine

C17H29N — CID 70220454

IUPAC1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine
SMILESCC1=C2C(C)C(C)C3CCCCC3N2C(C)CC1
InChIInChI=1S/C17H29N/c1-11-9-10-12(2)18-16-8-6-5-7-15(16)13(3)14(4)17(11)18/h12-16H,5-10H2,1-4H3
InChIKeyVDPNQCQFSHLMEY-UHFFFAOYSA-N
MW247.43 g/mol
LogP4.59
Rot. Bonds

About 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine

1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine (PubChem CID 70220454) has the molecular formula C17H29N and a molecular weight of 247.43 g/mol. Its IUPAC name is 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine.

Molecular Properties

Compound Name1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine
PubChem CID70220454
Molecular FormulaC17H29N
Molecular Weight247.43 g/mol
Exact Mass247.23
IUPAC Name1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine
SMILESCC1=C2C(C)C(C)C3CCCCC3N2C(C)CC1
InChIInChI=1S/C17H29N/c1-11-9-10-12(2)18-16-8-6-5-7-15(16)13(3)14(4)17(11)18/h12-16H,5-10H2,1-4H3
InChIKeyVDPNQCQFSHLMEY-UHFFFAOYSA-N
XLogP4.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.43
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine?
The IUPAC name of 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine (CID 70220454) is 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine.
What is the SMILES notation for 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine?
The canonical SMILES for 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine is CC1=C2C(C)C(C)C3CCCCC3N2C(C)CC1.
What is the InChIKey of 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine?
The InChIKey is VDPNQCQFSHLMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N/c1-11-9-10-12(2)18-16-8-6-5-7-15(16)13(3)14(4)17(11)18/h12-16H,5-10H2,1-4H3.
What are the key properties of 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine?
1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine has a molecular weight of 247.43 g/mol, XLogP of 4.59, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,5,6-tetramethyl-2,3,5,6,6a,7,8,9,10,10a-decahydro-1H-benzo[c]quinolizine is sourced from PubChem (CID 70220454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).