ethanamine;ethane-1,2-diamine;ethene

C8H23N3 — CID 22315764

IUPACethanamine;ethane-1,2-diamine;ethene
SMILESC=C.C=C.CCN.NCCN
InChIInChI=1S/C2H8N2.C2H7N.2C2H4/c3-1-2-4;1-2-3;2*1-2/h1-4H2;2-3H2,1H3;2*1-2H2
InChIKeyYIOODRMSJLWHKW-UHFFFAOYSA-N
MW161.29 g/mol
LogP0.47
Rot. Bonds1

About ethanamine;ethane-1,2-diamine;ethene

ethanamine;ethane-1,2-diamine;ethene (PubChem CID 22315764) has the molecular formula C8H23N3 and a molecular weight of 161.29 g/mol. Its IUPAC name is ethanamine;ethane-1,2-diamine;ethene.

Molecular Properties

Compound Nameethanamine;ethane-1,2-diamine;ethene
PubChem CID22315764
Molecular FormulaC8H23N3
Molecular Weight161.29 g/mol
Exact Mass161.19
IUPAC Nameethanamine;ethane-1,2-diamine;ethene
SMILESC=C.C=C.CCN.NCCN
InChIInChI=1S/C2H8N2.C2H7N.2C2H4/c3-1-2-4;1-2-3;2*1-2/h1-4H2;2-3H2,1H3;2*1-2H2
InChIKeyYIOODRMSJLWHKW-UHFFFAOYSA-N
XLogP0.47
TPSA78.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.29
LogP ≤ 50.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethanamine;ethene;hydrate
CID 175328912
ethanamine;ethane;ethane-1,2-diamine
CID 144954036
ethanamine;stannane;hydrochloride
CID 173419360
CID 88517932
CID 88517932
ethanamine;ethane
CID 142339743
ethanamine;yttrium
CID 158796558
ethanamine;dihydrofluoride
CID 173025850
ethanamine;ethane
CID 22406574
ethanamine;dihydrochloride
CID 173015801
ethanamine;tetrahydrochloride
CID 175906401
argon;ethanamine;methane
CID 159572652
ethanamine;methanol
CID 159539719

Frequently Asked Questions

What is the IUPAC name of ethanamine;ethane-1,2-diamine;ethene?
The IUPAC name of ethanamine;ethane-1,2-diamine;ethene (CID 22315764) is ethanamine;ethane-1,2-diamine;ethene.
What is the SMILES notation for ethanamine;ethane-1,2-diamine;ethene?
The canonical SMILES for ethanamine;ethane-1,2-diamine;ethene is C=C.C=C.CCN.NCCN.
What is the InChIKey of ethanamine;ethane-1,2-diamine;ethene?
The InChIKey is YIOODRMSJLWHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2.C2H7N.2C2H4/c3-1-2-4;1-2-3;2*1-2/h1-4H2;2-3H2,1H3;2*1-2H2.
What are the key properties of ethanamine;ethane-1,2-diamine;ethene?
ethanamine;ethane-1,2-diamine;ethene has a molecular weight of 161.29 g/mol, XLogP of 0.47, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethanamine;ethane-1,2-diamine;ethene is sourced from PubChem (CID 22315764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).