2-methylideneimidazolidine

C4H8N2 — CID 22345945

IUPAC2-methylideneimidazolidine
SMILESC=C1NCCN1
InChIInChI=1S/C4H8N2/c1-4-5-2-3-6-4/h5-6H,1-3H2
InChIKeyROLNAQAIJCRSCC-UHFFFAOYSA-N
MW84.12 g/mol
LogP-0.35
Rot. Bonds

About 2-methylideneimidazolidine

2-methylideneimidazolidine (PubChem CID 22345945) has the molecular formula C4H8N2 and a molecular weight of 84.12 g/mol. Its IUPAC name is 2-methylideneimidazolidine.

Molecular Properties

Compound Name2-methylideneimidazolidine
PubChem CID22345945
Molecular FormulaC4H8N2
Molecular Weight84.12 g/mol
Exact Mass84.07
IUPAC Name2-methylideneimidazolidine
SMILESC=C1NCCN1
InChIInChI=1S/C4H8N2/c1-4-5-2-3-6-4/h5-6H,1-3H2
InChIKeyROLNAQAIJCRSCC-UHFFFAOYSA-N
XLogP-0.35
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.12
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methylideneimidazolidine?
The IUPAC name of 2-methylideneimidazolidine (CID 22345945) is 2-methylideneimidazolidine.
What is the SMILES notation for 2-methylideneimidazolidine?
The canonical SMILES for 2-methylideneimidazolidine is C=C1NCCN1.
What is the InChIKey of 2-methylideneimidazolidine?
The InChIKey is ROLNAQAIJCRSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2/c1-4-5-2-3-6-4/h5-6H,1-3H2.
What are the key properties of 2-methylideneimidazolidine?
2-methylideneimidazolidine has a molecular weight of 84.12 g/mol, XLogP of -0.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylideneimidazolidine is sourced from PubChem (CID 22345945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).