ethane;N-ethenylethanamine

C6H15N — CID 143788319

IUPACethane;N-ethenylethanamine
SMILESC=CNCC.CC
InChIInChI=1S/C4H9N.C2H6/c1-3-5-4-2;1-2/h3,5H,1,4H2,2H3;1-2H3
InChIKeyACFVOCIDQCQSRA-UHFFFAOYSA-N
MW101.19 g/mol
LogP1.77
Rot. Bonds2

About ethane;N-ethenylethanamine

ethane;N-ethenylethanamine (PubChem CID 143788319) has the molecular formula C6H15N and a molecular weight of 101.19 g/mol. Its IUPAC name is ethane;N-ethenylethanamine.

Molecular Properties

Compound Nameethane;N-ethenylethanamine
PubChem CID143788319
Molecular FormulaC6H15N
Molecular Weight101.19 g/mol
Exact Mass101.12
IUPAC Nameethane;N-ethenylethanamine
SMILESC=CNCC.CC
InChIInChI=1S/C4H9N.C2H6/c1-3-5-4-2;1-2/h3,5H,1,4H2,2H3;1-2H3
InChIKeyACFVOCIDQCQSRA-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.19
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;N-ethenylethanamine?
The IUPAC name of ethane;N-ethenylethanamine (CID 143788319) is ethane;N-ethenylethanamine.
What is the SMILES notation for ethane;N-ethenylethanamine?
The canonical SMILES for ethane;N-ethenylethanamine is C=CNCC.CC.
What is the InChIKey of ethane;N-ethenylethanamine?
The InChIKey is ACFVOCIDQCQSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N.C2H6/c1-3-5-4-2;1-2/h3,5H,1,4H2,2H3;1-2H3.
What are the key properties of ethane;N-ethenylethanamine?
ethane;N-ethenylethanamine has a molecular weight of 101.19 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-ethenylethanamine is sourced from PubChem (CID 143788319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).