8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene

C9H10N2 — CID 123430510

IUPAC8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene
SMILESCC1=NC2C=CC=CC(=C2)N1
InChIInChI=1S/C9H10N2/c1-7-10-8-4-2-3-5-9(6-8)11-7/h2-6,8H,1H3,(H,10,11)
InChIKeyWLMGFYPISNSUII-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.39
Rot. Bonds

About 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene

8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene (PubChem CID 123430510) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene.

Molecular Properties

Compound Name8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene
PubChem CID123430510
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene
SMILESCC1=NC2C=CC=CC(=C2)N1
InChIInChI=1S/C9H10N2/c1-7-10-8-4-2-3-5-9(6-8)11-7/h2-6,8H,1H3,(H,10,11)
InChIKeyWLMGFYPISNSUII-UHFFFAOYSA-N
XLogP1.39
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene with MolForge

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Related Compounds

2-methyl-3a,4-dihydro-1H-benzimidazole
CID 19090012
(5Z,7Z)-2-methyl-9-methylidene-1,4-dihydro-1,3-diazonine
CID 68220253
2,4,6-Trimethyl-1,4-dihydropyrimidine
CID 68611629
N-cyclohexa-1,3-dien-1-yl-N'-[(Z)-hex-4-enyl]ethanimidamide
CID 70875583
6-But-1-enyl-2,4-dimethyl-1,4-dihydropyrimidine
CID 91498996
4-ethyl-2-methyl-6-[(1Z)-penta-1,3-dienyl]-1,4-dihydropyrimidine
CID 123186985
6-Buta-1,3-dienyl-2,4-dimethyl-1,4-dihydropyrimidine
CID 123490451
2,4-Dimethyl-5-methylidene-1,4-dihydro-1,3-diazepine-7-carbonitrile
CID 123536555
2,6-Dimethyl-9-methylidene-1,4-dihydro-1,3-diazonine
CID 123595612
(7Z)-2-methyl-9-methylidene-1,4-dihydro-1,3-diazonine
CID 123778633
8-Methyl-3,7,9-triazabicyclo[4.3.1]deca-6(10),8-diene
CID 130257225
N-cyclohexa-1,3-dien-1-yl-N'-methylethanimidamide
CID 141893272

Frequently Asked Questions

What is the IUPAC name of 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene?
The IUPAC name of 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene (CID 123430510) is 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene.
What is the SMILES notation for 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene?
The canonical SMILES for 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene is CC1=NC2C=CC=CC(=C2)N1.
What is the InChIKey of 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene?
The InChIKey is WLMGFYPISNSUII-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-7-10-8-4-2-3-5-9(6-8)11-7/h2-6,8H,1H3,(H,10,11).
What are the key properties of 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene?
8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene has a molecular weight of 146.19 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-7,9-diazabicyclo[4.3.1]deca-1(10),2,4,7-tetraene is sourced from PubChem (CID 123430510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).