4,5-di(ethylidene)pyrimidine

C8H10N2 — CID 123777502

IUPAC4,5-di(ethylidene)pyrimidine
SMILESCC=c1cncnc1=CC
InChIInChI=1S/C8H10N2/c1-3-7-5-9-6-10-8(7)4-2/h3-6H,1-2H3
InChIKeyZIXMYKWABDLRQB-UHFFFAOYSA-N
MW134.18 g/mol
LogP0.08
Rot. Bonds

About 4,5-di(ethylidene)pyrimidine

4,5-di(ethylidene)pyrimidine (PubChem CID 123777502) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 4,5-di(ethylidene)pyrimidine.

Molecular Properties

Compound Name4,5-di(ethylidene)pyrimidine
PubChem CID123777502
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name4,5-di(ethylidene)pyrimidine
SMILESCC=c1cncnc1=CC
InChIInChI=1S/C8H10N2/c1-3-7-5-9-6-10-8(7)4-2/h3-6H,1-2H3
InChIKeyZIXMYKWABDLRQB-UHFFFAOYSA-N
XLogP0.08
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3Z)-3-(methyliminomethyl)hexa-1,3-dien-2-amine
CID 60123978
(3Z)-3-ethylidene-N-methylpyridin-2-imine
CID 68010675
6,6-Dimethylcyclohepta[d]pyrimidine
CID 70316666
(2E)-N-methyl-2-(3-methylidene-2-pyridinylidene)ethanimine
CID 88271063
(2E,3Z)-2,3-di(ethylidene)pyridine
CID 88552849
8H-quinazolin-8-ide;rhodium
CID 88955705
(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine
CID 89038797
6,6-Dimethylpyrimido[4,5-c]azepine
CID 89075690
(7R)-7-methyl-6,7-dihydroquinazoline
CID 89097060
3-Ethyl-6,7-dihydroquinoline
CID 89097266
(2E,3Z)-2-ethylidene-3-propylidenepyridine
CID 89097805
(2Z,4E,6Z)-N-methyl-6-(2-methylidene-3-pyridinylidene)hexa-2,4-dien-1-imine
CID 89112517

Frequently Asked Questions

What is the IUPAC name of 4,5-di(ethylidene)pyrimidine?
The IUPAC name of 4,5-di(ethylidene)pyrimidine (CID 123777502) is 4,5-di(ethylidene)pyrimidine.
What is the SMILES notation for 4,5-di(ethylidene)pyrimidine?
The canonical SMILES for 4,5-di(ethylidene)pyrimidine is CC=c1cncnc1=CC.
What is the InChIKey of 4,5-di(ethylidene)pyrimidine?
The InChIKey is ZIXMYKWABDLRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-3-7-5-9-6-10-8(7)4-2/h3-6H,1-2H3.
What are the key properties of 4,5-di(ethylidene)pyrimidine?
4,5-di(ethylidene)pyrimidine has a molecular weight of 134.18 g/mol, XLogP of 0.08, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-di(ethylidene)pyrimidine is sourced from PubChem (CID 123777502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).