(6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine

C8H12N2 — CID 130389549

IUPAC(6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine
SMILESC=C1C=NCN/C1=C\CC
InChIInChI=1S/C8H12N2/c1-3-4-8-7(2)5-9-6-10-8/h4-5,10H,2-3,6H2,1H3/b8-4-
InChIKeyCCADUYKSCKQFLN-YWEYNIOJSA-N
MW136.20 g/mol
LogP1.47
Rot. Bonds1

About (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine

(6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine (PubChem CID 130389549) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine.

Molecular Properties

Compound Name(6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine
PubChem CID130389549
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name(6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine
SMILESC=C1C=NCN/C1=C\CC
InChIInChI=1S/C8H12N2/c1-3-4-8-7(2)5-9-6-10-8/h4-5,10H,2-3,6H2,1H3/b8-4-
InChIKeyCCADUYKSCKQFLN-YWEYNIOJSA-N
XLogP1.47
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
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

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Frequently Asked Questions

What is the IUPAC name of (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine?
The IUPAC name of (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine (CID 130389549) is (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine.
What is the SMILES notation for (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine?
The canonical SMILES for (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine is C=C1C=NCN/C1=C\CC.
What is the InChIKey of (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine?
The InChIKey is CCADUYKSCKQFLN-YWEYNIOJSA-N. The full InChI is InChI=1S/C8H12N2/c1-3-4-8-7(2)5-9-6-10-8/h4-5,10H,2-3,6H2,1H3/b8-4-.
What are the key properties of (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine?
(6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine has a molecular weight of 136.20 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-5-methylidene-6-propylidene-1,2-dihydropyrimidine is sourced from PubChem (CID 130389549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).