1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine

C12H22N2 — CID 5246377

IUPAC1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine
SMILESC1CCC2NC3CCCCC3NC2C1
InChIInChI=1S/C12H22N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h9-14H,1-8H2
InChIKeyJPOVEXSHVNWPRM-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.80
Rot. Bonds

About 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine

1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine (PubChem CID 5246377) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine.

Molecular Properties

Compound Name1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine
PubChem CID5246377
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine
SMILESC1CCC2NC3CCCCC3NC2C1
InChIInChI=1S/C12H22N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h9-14H,1-8H2
InChIKeyJPOVEXSHVNWPRM-UHFFFAOYSA-N
XLogP1.80
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine 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 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine?
The IUPAC name of 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine (CID 5246377) is 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine.
What is the SMILES notation for 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine?
The canonical SMILES for 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine is C1CCC2NC3CCCCC3NC2C1.
What is the InChIKey of 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine?
The InChIKey is JPOVEXSHVNWPRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h9-14H,1-8H2.
What are the key properties of 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine?
1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine has a molecular weight of 194.32 g/mol, XLogP of 1.80, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrophenazine is sourced from PubChem (CID 5246377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).