(6Z,8Z)-10-methylidene-5H-1,4-diazecine

C9H10N2 — CID 134536512

IUPAC(6Z,8Z)-10-methylidene-5H-1,4-diazecine
SMILESC=C1/C=C\C=C/C/N=C\C=N/1
InChIInChI=1S/C9H10N2/c1-9-5-3-2-4-6-10-7-8-11-9/h2-5,7-8H,1,6H2/b4-2-,5-3-,10-7-,11-8-
InChIKeyRFOGMMZZMVXVSG-AHPKYKJFSA-N
MW146.19 g/mol
LogP1.77
Rot. Bonds

About (6Z,8Z)-10-methylidene-5H-1,4-diazecine

(6Z,8Z)-10-methylidene-5H-1,4-diazecine (PubChem CID 134536512) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is (6Z,8Z)-10-methylidene-5H-1,4-diazecine.

Molecular Properties

Compound Name(6Z,8Z)-10-methylidene-5H-1,4-diazecine
PubChem CID134536512
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name(6Z,8Z)-10-methylidene-5H-1,4-diazecine
SMILESC=C1/C=C\C=C/C/N=C\C=N/1
InChIInChI=1S/C9H10N2/c1-9-5-3-2-4-6-10-7-8-11-9/h2-5,7-8H,1,6H2/b4-2-,5-3-,10-7-,11-8-
InChIKeyRFOGMMZZMVXVSG-AHPKYKJFSA-N
XLogP1.77
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6Z,8Z)-10-methylidene-5H-1,4-diazecine?
The IUPAC name of (6Z,8Z)-10-methylidene-5H-1,4-diazecine (CID 134536512) is (6Z,8Z)-10-methylidene-5H-1,4-diazecine.
What is the SMILES notation for (6Z,8Z)-10-methylidene-5H-1,4-diazecine?
The canonical SMILES for (6Z,8Z)-10-methylidene-5H-1,4-diazecine is C=C1/C=C\C=C/C/N=C\C=N/1.
What is the InChIKey of (6Z,8Z)-10-methylidene-5H-1,4-diazecine?
The InChIKey is RFOGMMZZMVXVSG-AHPKYKJFSA-N. The full InChI is InChI=1S/C9H10N2/c1-9-5-3-2-4-6-10-7-8-11-9/h2-5,7-8H,1,6H2/b4-2-,5-3-,10-7-,11-8-.
What are the key properties of (6Z,8Z)-10-methylidene-5H-1,4-diazecine?
(6Z,8Z)-10-methylidene-5H-1,4-diazecine has a molecular weight of 146.19 g/mol, XLogP of 1.77, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z,8Z)-10-methylidene-5H-1,4-diazecine is sourced from PubChem (CID 134536512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).