(6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene

C16H22N2 — CID 19879747

IUPAC(6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene
SMILESCC1C2CC3CC4=C(C=C3N2)/C=C\CNC1(C)C4
InChIInChI=1S/C16H22N2/c1-10-14-8-12-6-13-9-16(10,2)17-5-3-4-11(13)7-15(12)18-14/h3-4,7,10,12,14,17-18H,5-6,8-9H2,1-2H3/b4-3-
InChIKeyKXBDANILXWQAGL-ARJAWSKDSA-N
MW242.37 g/mol
LogP2.51
Rot. Bonds

About (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene

(6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene (PubChem CID 19879747) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene.

Molecular Properties

Compound Name(6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene
PubChem CID19879747
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name(6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene
SMILESCC1C2CC3CC4=C(C=C3N2)/C=C\CNC1(C)C4
InChIInChI=1S/C16H22N2/c1-10-14-8-12-6-13-9-16(10,2)17-5-3-4-11(13)7-15(12)18-14/h3-4,7,10,12,14,17-18H,5-6,8-9H2,1-2H3/b4-3-
InChIKeyKXBDANILXWQAGL-ARJAWSKDSA-N
XLogP2.51
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene 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 (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene?
The IUPAC name of (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene (CID 19879747) is (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene.
What is the SMILES notation for (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene?
The canonical SMILES for (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene is CC1C2CC3CC4=C(C=C3N2)/C=C\CNC1(C)C4.
What is the InChIKey of (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene?
The InChIKey is KXBDANILXWQAGL-ARJAWSKDSA-N. The full InChI is InChI=1S/C16H22N2/c1-10-14-8-12-6-13-9-16(10,2)17-5-3-4-11(13)7-15(12)18-14/h3-4,7,10,12,14,17-18H,5-6,8-9H2,1-2H3/b4-3-.
What are the key properties of (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene?
(6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene has a molecular weight of 242.37 g/mol, XLogP of 2.51, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-10,16-dimethyl-2,9-diazatetracyclo[8.5.1.03,14.05,12]hexadeca-3,5(12),6-triene is sourced from PubChem (CID 19879747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).