(E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine

C8H11NO — CID 89230411

IUPAC(E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine
SMILESC=C/C=C1/CCO/C1=C/N
InChIInChI=1S/C8H11NO/c1-2-3-7-4-5-10-8(7)6-9/h2-3,6H,1,4-5,9H2/b7-3-,8-6+
InChIKeyJYHBPLWQTPIQTF-SYTHDNBVSA-N
MW137.18 g/mol
LogP1.32
Rot. Bonds1

About (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine

(E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine (PubChem CID 89230411) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine.

Molecular Properties

Compound Name(E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine
PubChem CID89230411
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name(E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine
SMILESC=C/C=C1/CCO/C1=C/N
InChIInChI=1S/C8H11NO/c1-2-3-7-4-5-10-8(7)6-9/h2-3,6H,1,4-5,9H2/b7-3-,8-6+
InChIKeyJYHBPLWQTPIQTF-SYTHDNBVSA-N
XLogP1.32
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine?
The IUPAC name of (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine (CID 89230411) is (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine.
What is the SMILES notation for (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine?
The canonical SMILES for (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine is C=C/C=C1/CCO/C1=C/N.
What is the InChIKey of (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine?
The InChIKey is JYHBPLWQTPIQTF-SYTHDNBVSA-N. The full InChI is InChI=1S/C8H11NO/c1-2-3-7-4-5-10-8(7)6-9/h2-3,6H,1,4-5,9H2/b7-3-,8-6+.
What are the key properties of (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine?
(E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine has a molecular weight of 137.18 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-[(3Z)-3-prop-2-enylideneoxolan-2-ylidene]methanamine is sourced from PubChem (CID 89230411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).