10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene

C17H22N2 — CID 54208539

IUPAC10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene
SMILESCC1C2CC3=C(CCC4=C3C=C/N=C\CC41C)N2C
InChIInChI=1S/C17H22N2/c1-11-16-10-13-12-6-8-18-9-7-17(11,2)14(12)4-5-15(13)19(16)3/h6,8-9,11,16H,4-5,7,10H2,1-3H3/b8-6?,18-9-
InChIKeyPUGRAKOPUZOFKT-JNDPZMKHSA-N
MW254.38 g/mol
LogP3.68
Rot. Bonds

About 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene

10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene (PubChem CID 54208539) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene.

Molecular Properties

Compound Name10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene
PubChem CID54208539
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene
SMILESCC1C2CC3=C(CCC4=C3C=C/N=C\CC41C)N2C
InChIInChI=1S/C17H22N2/c1-11-16-10-13-12-6-8-18-9-7-17(11,2)14(12)4-5-15(13)19(16)3/h6,8-9,11,16H,4-5,7,10H2,1-3H3/b8-6?,18-9-
InChIKeyPUGRAKOPUZOFKT-JNDPZMKHSA-N
XLogP3.68
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene with MolForge

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

Launch Full Analysis

Related Compounds

(5Z)-15-(cyclopropylmethyl)-10,16-dimethyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879718
(5Z)-10,16-diethyl-15-methyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879722
(5E)-6-chloro-15-ethyl-10,16-dimethyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879728
(5Z)-10,15,16-trimethyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879732
(5E)-6-chloro-10,15,16-trimethyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879735
(5Z)-15-methyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879738
(5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879755
(5Z)-10,16-dimethyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene-15-carbonitrile
CID 19879767
(5E)-6-chloro-10,16-dimethyl-15-prop-2-enyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879768
(5Z)-10,16-dimethyl-15-(3-methylbut-2-enyl)-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879774
(5Z,8Z)-10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879779
(5Z)-10,16-dimethyl-15-prop-2-enyl-8,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
CID 19879793

Frequently Asked Questions

What is the IUPAC name of 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene?
The IUPAC name of 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene (CID 54208539) is 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene.
What is the SMILES notation for 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene?
The canonical SMILES for 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene is CC1C2CC3=C(CCC4=C3C=C/N=C\CC41C)N2C.
What is the InChIKey of 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene?
The InChIKey is PUGRAKOPUZOFKT-JNDPZMKHSA-N. The full InChI is InChI=1S/C17H22N2/c1-11-16-10-13-12-6-8-18-9-7-17(11,2)14(12)4-5-15(13)19(16)3/h6,8-9,11,16H,4-5,7,10H2,1-3H3/b8-6?,18-9-.
What are the key properties of 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene?
10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene has a molecular weight of 254.38 g/mol, XLogP of 3.68, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10,15,16-trimethyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,7-tetraene is sourced from PubChem (CID 54208539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).