11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one

C15H12N2O — CID 11736496

IUPAC11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one
SMILESCn1c2c(c3c4ccccc4ncc31)C(=O)CC2
InChIInChI=1S/C15H12N2O/c1-17-11-6-7-13(18)15(11)14-9-4-2-3-5-10(9)16-8-12(14)17/h2-5,8H,6-7H2,1H3
InChIKeyZIJXNCDNZREAMV-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.86
Rot. Bonds

About 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one

11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one (PubChem CID 11736496) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one.

Molecular Properties

Compound Name11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one
PubChem CID11736496
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one
SMILESCn1c2c(c3c4ccccc4ncc31)C(=O)CC2
InChIInChI=1S/C15H12N2O/c1-17-11-6-7-13(18)15(11)14-9-4-2-3-5-10(9)16-8-12(14)17/h2-5,8H,6-7H2,1H3
InChIKeyZIJXNCDNZREAMV-UHFFFAOYSA-N
XLogP2.86
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one with MolForge

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Related Compounds

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CID 603347
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CID 12026696
(3E)-3-(1H-imidazol-2-ylmethylidene)-9-methyl-1,2-dihydrocarbazol-4-one
CID 23036580
11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one
CID 164675978
3-propan-2-yl-1H-imidazo[4,5-c]quinolin-2-one
CID 151683371
2-(1-methylpyrazol-4-yl)-2,4-dihydro-1H-pyrazino[2,3-c]quinolin-3-one
CID 103964991
ethane;9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one
CID 142101652
bis(9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one);hydrochloride
CID 160789760
1,3-dihydropyrrolo[2,3-c]quinolin-2-one
CID 178065999
1-ethyl-3,5-dihydro-2H-[1,4]diazepino[2,3-c]quinolin-4-one
CID 103964938
5-methyl-9-[(5-methyl-1H-imidazol-4-yl)methylidene]-7,8-dihydro-6H-cyclohepta[b]indol-10-one
CID 67885622
8,9-dimethyl-2,3-dihydro-1H-carbazol-4-one
CID 84739991

Frequently Asked Questions

What is the IUPAC name of 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one?
The IUPAC name of 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one (CID 11736496) is 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one.
What is the SMILES notation for 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one?
The canonical SMILES for 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one is Cn1c2c(c3c4ccccc4ncc31)C(=O)CC2.
What is the InChIKey of 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one?
The InChIKey is ZIJXNCDNZREAMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-17-11-6-7-13(18)15(11)14-9-4-2-3-5-10(9)16-8-12(14)17/h2-5,8H,6-7H2,1H3.
What are the key properties of 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one?
11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one has a molecular weight of 236.27 g/mol, XLogP of 2.86, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-8,11-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-1(10),2,4,6,8,12(16)-hexaen-15-one is sourced from PubChem (CID 11736496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).