ethane;1-morpholin-4-ylethenamine

C8H18N2O — CID 143534968

IUPACethane;1-morpholin-4-ylethenamine
SMILESC=C(N)N1CCOCC1.CC
InChIInChI=1S/C6H12N2O.C2H6/c1-6(7)8-2-4-9-5-3-8;1-2/h1-5,7H2;1-2H3
InChIKeySSIWBEJNVBNYPV-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.77
Rot. Bonds1

About ethane;1-morpholin-4-ylethenamine

ethane;1-morpholin-4-ylethenamine (PubChem CID 143534968) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is ethane;1-morpholin-4-ylethenamine.

Molecular Properties

Compound Nameethane;1-morpholin-4-ylethenamine
PubChem CID143534968
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Nameethane;1-morpholin-4-ylethenamine
SMILESC=C(N)N1CCOCC1.CC
InChIInChI=1S/C6H12N2O.C2H6/c1-6(7)8-2-4-9-5-3-8;1-2/h1-5,7H2;1-2H3
InChIKeySSIWBEJNVBNYPV-UHFFFAOYSA-N
XLogP0.77
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;1-morpholin-4-ylethenamine?
The IUPAC name of ethane;1-morpholin-4-ylethenamine (CID 143534968) is ethane;1-morpholin-4-ylethenamine.
What is the SMILES notation for ethane;1-morpholin-4-ylethenamine?
The canonical SMILES for ethane;1-morpholin-4-ylethenamine is C=C(N)N1CCOCC1.CC.
What is the InChIKey of ethane;1-morpholin-4-ylethenamine?
The InChIKey is SSIWBEJNVBNYPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.C2H6/c1-6(7)8-2-4-9-5-3-8;1-2/h1-5,7H2;1-2H3.
What are the key properties of ethane;1-morpholin-4-ylethenamine?
ethane;1-morpholin-4-ylethenamine has a molecular weight of 158.24 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-morpholin-4-ylethenamine is sourced from PubChem (CID 143534968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).