(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine

C11H14N2 — CID 89038797

IUPAC(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine
SMILESC=c1ncnc(C)/c1=C/C=C\CC
InChIInChI=1S/C11H14N2/c1-4-5-6-7-11-9(2)12-8-13-10(11)3/h5-8H,2,4H2,1,3H3/b6-5-,11-7+
InChIKeyIABXZBWOYAPYAY-GNLLZQBYSA-N
MW174.25 g/mol
LogP0.94
Rot. Bonds2

About (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine

(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine (PubChem CID 89038797) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine.

Molecular Properties

Compound Name(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine
PubChem CID89038797
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine
SMILESC=c1ncnc(C)/c1=C/C=C\CC
InChIInChI=1S/C11H14N2/c1-4-5-6-7-11-9(2)12-8-13-10(11)3/h5-8H,2,4H2,1,3H3/b6-5-,11-7+
InChIKeyIABXZBWOYAPYAY-GNLLZQBYSA-N
XLogP0.94
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine?
The IUPAC name of (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine (CID 89038797) is (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine.
What is the SMILES notation for (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine?
The canonical SMILES for (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine is C=c1ncnc(C)/c1=C/C=C\CC.
What is the InChIKey of (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine?
The InChIKey is IABXZBWOYAPYAY-GNLLZQBYSA-N. The full InChI is InChI=1S/C11H14N2/c1-4-5-6-7-11-9(2)12-8-13-10(11)3/h5-8H,2,4H2,1,3H3/b6-5-,11-7+.
What are the key properties of (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine?
(5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine has a molecular weight of 174.25 g/mol, XLogP of 0.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-4-methyl-6-methylidene-5-[(Z)-pent-2-enylidene]pyrimidine is sourced from PubChem (CID 89038797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).