(6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine

C8H12N2 — CID 143091425

IUPAC(6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine
SMILESC/C1=N\CC/C=C/C=C\N1
InChIInChI=1S/C8H12N2/c1-8-9-6-4-2-3-5-7-10-8/h2-4,6H,5,7H2,1H3,(H,9,10)/b3-2+,6-4-
InChIKeyCWSPXOSVFQCDLN-ZPYFUIHZSA-N
MW136.20 g/mol
LogP1.47
Rot. Bonds

About (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine

(6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine (PubChem CID 143091425) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine.

Molecular Properties

Compound Name(6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine
PubChem CID143091425
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name(6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine
SMILESC/C1=N\CC/C=C/C=C\N1
InChIInChI=1S/C8H12N2/c1-8-9-6-4-2-3-5-7-10-8/h2-4,6H,5,7H2,1H3,(H,9,10)/b3-2+,6-4-
InChIKeyCWSPXOSVFQCDLN-ZPYFUIHZSA-N
XLogP1.47
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine with MolForge

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Launch Full Analysis

Related Compounds

N-butyl-1,3-dihydroazepin-2-imine
CID 137197350
N-methyl-1,3-dihydroazepin-2-imine
CID 136209100
N-[(1E,3E)-hexa-1,3-dienyl]-N'-methylmethanimidamide
CID 89224939
N-[(Z)-but-1-enyl]-N'-methylethanimidamide
CID 89347354
N'-cyclohexa-2,4-dien-1-yl-N-ethenylethanimidamide
CID 91616301
(8E)-2-methyl-6,7-dihydro-1H-1,3-diazonine
CID 123300903
N-ethenyl-N'-[(1Z,3E)-2-ethyl-3-methylhexa-1,3,5-trienyl]ethanimidamide
CID 132170857
N-ethenyl-N'-[(1Z,3E)-3-methyl-4-propan-2-ylhexa-1,3,5-trienyl]ethanimidamide
CID 134214378
N'-[(1Z,3E)-2,3-dimethylhexa-1,3,5-trienyl]-N-ethenylethanimidamide
CID 134214435
N,3,6-trimethyl-1,3-dihydroazepin-2-imine
CID 137084627
2-methyl-5-[(Z)-prop-1-enyl]-1,4-dihydropyrimidine
CID 138509396
2-but-1-enyl-1-methyl-1H-imidazol-1-ium bromide
CID 140655013

Frequently Asked Questions

What is the IUPAC name of (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine?
The IUPAC name of (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine (CID 143091425) is (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine.
What is the SMILES notation for (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine?
The canonical SMILES for (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine is C/C1=N\CC/C=C/C=C\N1.
What is the InChIKey of (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine?
The InChIKey is CWSPXOSVFQCDLN-ZPYFUIHZSA-N. The full InChI is InChI=1S/C8H12N2/c1-8-9-6-4-2-3-5-7-10-8/h2-4,6H,5,7H2,1H3,(H,9,10)/b3-2+,6-4-.
What are the key properties of (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine?
(6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine has a molecular weight of 136.20 g/mol, XLogP of 1.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,8Z)-2-methyl-4,5-dihydro-1H-1,3-diazonine is sourced from PubChem (CID 143091425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).