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

C7H10N2 — CID 139242703

IUPAC(4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine
SMILESC1=C\C=C/NCN\C=C/1
InChIInChI=1S/C7H10N2/c1-2-4-6-9-7-8-5-3-1/h1-6,8-9H,7H2/b2-1-,5-3-,6-4-
InChIKeyCVVUZWMHLSWHEP-XCADPSHZSA-N
MW122.17 g/mol
LogP0.72
Rot. Bonds

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

(4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine (PubChem CID 139242703) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine.

Molecular Properties

Compound Name(4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine
PubChem CID139242703
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name(4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine
SMILESC1=C\C=C/NCN\C=C/1
InChIInChI=1S/C7H10N2/c1-2-4-6-9-7-8-5-3-1/h1-6,8-9H,7H2/b2-1-,5-3-,6-4-
InChIKeyCVVUZWMHLSWHEP-XCADPSHZSA-N
XLogP0.72
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine?
The IUPAC name of (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine (CID 139242703) is (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine.
What is the SMILES notation for (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine?
The canonical SMILES for (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine is C1=C\C=C/NCN\C=C/1.
What is the InChIKey of (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine?
The InChIKey is CVVUZWMHLSWHEP-XCADPSHZSA-N. The full InChI is InChI=1S/C7H10N2/c1-2-4-6-9-7-8-5-3-1/h1-6,8-9H,7H2/b2-1-,5-3-,6-4-.
What are the key properties of (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine?
(4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine has a molecular weight of 122.17 g/mol, XLogP of 0.72, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,6Z,8Z)-2,3-dihydro-1H-1,3-diazonine is sourced from PubChem (CID 139242703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).