[(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine

C8H13NO — CID 130191118

IUPAC[(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine
SMILESC=C1OC(CN)C/C1=C/C
InChIInChI=1S/C8H13NO/c1-3-7-4-8(5-9)10-6(7)2/h3,8H,2,4-5,9H2,1H3/b7-3-
InChIKeyPDAAAGNDHCXOHE-CLTKARDFSA-N
MW139.20 g/mol
LogP1.19
Rot. Bonds1

About [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine

[(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine (PubChem CID 130191118) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine.

Molecular Properties

Compound Name[(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine
PubChem CID130191118
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name[(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine
SMILESC=C1OC(CN)C/C1=C/C
InChIInChI=1S/C8H13NO/c1-3-7-4-8(5-9)10-6(7)2/h3,8H,2,4-5,9H2,1H3/b7-3-
InChIKeyPDAAAGNDHCXOHE-CLTKARDFSA-N
XLogP1.19
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine?
The IUPAC name of [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine (CID 130191118) is [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine.
What is the SMILES notation for [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine?
The canonical SMILES for [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine is C=C1OC(CN)C/C1=C/C.
What is the InChIKey of [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine?
The InChIKey is PDAAAGNDHCXOHE-CLTKARDFSA-N. The full InChI is InChI=1S/C8H13NO/c1-3-7-4-8(5-9)10-6(7)2/h3,8H,2,4-5,9H2,1H3/b7-3-.
What are the key properties of [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine?
[(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine has a molecular weight of 139.20 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4Z)-4-ethylidene-5-methylideneoxolan-2-yl]methanamine is sourced from PubChem (CID 130191118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).