ethenamine;3-prop-2-enoxyprop-1-ene

C8H15NO — CID 174942640

IUPACethenamine;3-prop-2-enoxyprop-1-ene
SMILESC=CCOCC=C.C=CN
InChIInChI=1S/C6H10O.C2H5N/c1-3-5-7-6-4-2;1-2-3/h3-4H,1-2,5-6H2;2H,1,3H2
InChIKeyKYGMZCJNURVQMA-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.46
Rot. Bonds4

About ethenamine;3-prop-2-enoxyprop-1-ene

ethenamine;3-prop-2-enoxyprop-1-ene (PubChem CID 174942640) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is ethenamine;3-prop-2-enoxyprop-1-ene.

Molecular Properties

Compound Nameethenamine;3-prop-2-enoxyprop-1-ene
PubChem CID174942640
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Nameethenamine;3-prop-2-enoxyprop-1-ene
SMILESC=CCOCC=C.C=CN
InChIInChI=1S/C6H10O.C2H5N/c1-3-5-7-6-4-2;1-2-3/h3-4H,1-2,5-6H2;2H,1,3H2
InChIKeyKYGMZCJNURVQMA-UHFFFAOYSA-N
XLogP1.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze ethenamine;3-prop-2-enoxyprop-1-ene with MolForge

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

Launch Full Analysis

Related Compounds

Potassium allyloxide
CID 87828396
propan-1-amine;3-prop-2-enoxyprop-1-ene
CID 88606342
azane;3-prop-2-enoxyprop-1-ene;hydrochloride
CID 173111955
tris(prop-1-ene);3-prop-2-enoxyprop-1-ene
CID 175414947
CID 87625662
CID 87625662
3-prop-2-enoxyprop-1-ene;1,3,5-triazine-2,4,6-triamine
CID 66788334
propane-1,1,1-triol;3-prop-2-enoxyprop-1-ene
CID 175245535
isocyanic acid;3-prop-2-enoxyprop-1-ene
CID 88728289
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
CID 58112303
1-but-1-enoxybut-1-ene;3-prop-2-enoxyprop-1-ene
CID 173130431
(112C)ethenamine
CID 173062115
methane;1-prop-2-enoxypropane
CID 157267338

Frequently Asked Questions

What is the IUPAC name of ethenamine;3-prop-2-enoxyprop-1-ene?
The IUPAC name of ethenamine;3-prop-2-enoxyprop-1-ene (CID 174942640) is ethenamine;3-prop-2-enoxyprop-1-ene.
What is the SMILES notation for ethenamine;3-prop-2-enoxyprop-1-ene?
The canonical SMILES for ethenamine;3-prop-2-enoxyprop-1-ene is C=CCOCC=C.C=CN.
What is the InChIKey of ethenamine;3-prop-2-enoxyprop-1-ene?
The InChIKey is KYGMZCJNURVQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O.C2H5N/c1-3-5-7-6-4-2;1-2-3/h3-4H,1-2,5-6H2;2H,1,3H2.
What are the key properties of ethenamine;3-prop-2-enoxyprop-1-ene?
ethenamine;3-prop-2-enoxyprop-1-ene has a molecular weight of 141.21 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenamine;3-prop-2-enoxyprop-1-ene is sourced from PubChem (CID 174942640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).