(E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine

C7H11NO — CID 144833852

IUPAC(E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine
SMILESC/C=C1/CCO/C1=C/N
InChIInChI=1S/C7H11NO/c1-2-6-3-4-9-7(6)5-8/h2,5H,3-4,8H2,1H3/b6-2-,7-5+
InChIKeyFEHFDTCGWATSEL-GKUHRYDTSA-N
MW125.17 g/mol
LogP1.15
Rot. Bonds

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

(E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine (PubChem CID 144833852) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine.

Molecular Properties

Compound Name(E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine
PubChem CID144833852
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name(E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine
SMILESC/C=C1/CCO/C1=C/N
InChIInChI=1S/C7H11NO/c1-2-6-3-4-9-7(6)5-8/h2,5H,3-4,8H2,1H3/b6-2-,7-5+
InChIKeyFEHFDTCGWATSEL-GKUHRYDTSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethylidene-2-prop-2-enylideneoxolane
CID 91481308
(2E,3Z)-2-ethylidene-3-propylideneoxolane
CID 142121655
2-[(Z)-[(2E)-2-ethylideneoxolan-3-ylidene]methyl]-4,4-dimethylpent-1-en-3-amine
CID 142856991
(3E,4Z)-3,4-di(ethylidene)oxane;ethane
CID 143460049
(2E)-2-ethylidene-3-methylidene-1,4-dioxane
CID 144611337
(2Z,3Z)-3-[(Z)-but-2-enylidene]-2-ethylideneoxane
CID 89289028
(2Z,3Z)-3-(methylsulfanylmethylidene)-2-propylideneoxolane
CID 142123041
(1E,2Z)-1,2-di(ethylidene)cyclohexane
CID 102070913
1,2-di(ethylidene)cyclopropane
CID 123857340
1,2-di(ethylidene)cyclooctane
CID 134898176
(5Z)-5-[(3Z)-3-ethylideneoxolan-2-ylidene]-4-methylhepta-1,6-dien-2-ol
CID 142813174
4-ethylidene-3-prop-2-enylideneoxane
CID 91078972

Frequently Asked Questions

What is the IUPAC name of (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine?
The IUPAC name of (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine (CID 144833852) is (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine.
What is the SMILES notation for (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine?
The canonical SMILES for (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine is C/C=C1/CCO/C1=C/N.
What is the InChIKey of (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine?
The InChIKey is FEHFDTCGWATSEL-GKUHRYDTSA-N. The full InChI is InChI=1S/C7H11NO/c1-2-6-3-4-9-7(6)5-8/h2,5H,3-4,8H2,1H3/b6-2-,7-5+.
What are the key properties of (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine?
(E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine has a molecular weight of 125.17 g/mol, XLogP of 1.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-[(3Z)-3-ethylideneoxolan-2-ylidene]methanamine is sourced from PubChem (CID 144833852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).