ethene;3-methyliminopent-4-en-1-amine

C8H16N2 — CID 144855770

IUPACethene;3-methyliminopent-4-en-1-amine
SMILESC=C.C=C/C(CCN)=N\C
InChIInChI=1S/C6H12N2.C2H4/c1-3-6(8-2)4-5-7;1-2/h3H,1,4-5,7H2,2H3;1-2H2/b8-6+;
InChIKeyUCJRVSDLMMFNIZ-WVLIHFOGSA-N
MW140.23 g/mol
LogP1.39
Rot. Bonds3

About ethene;3-methyliminopent-4-en-1-amine

ethene;3-methyliminopent-4-en-1-amine (PubChem CID 144855770) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is ethene;3-methyliminopent-4-en-1-amine.

Molecular Properties

Compound Nameethene;3-methyliminopent-4-en-1-amine
PubChem CID144855770
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Nameethene;3-methyliminopent-4-en-1-amine
SMILESC=C.C=C/C(CCN)=N\C
InChIInChI=1S/C6H12N2.C2H4/c1-3-6(8-2)4-5-7;1-2/h3H,1,4-5,7H2,2H3;1-2H2/b8-6+;
InChIKeyUCJRVSDLMMFNIZ-WVLIHFOGSA-N
XLogP1.39
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze ethene;3-methyliminopent-4-en-1-amine 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

4-(but-3-en-2-ylideneamino)-N-propylbutan-1-amine
CID 54075907
(Z)-3-ethenyliminopent-1-ene-1,5-diamine
CID 89018201
1-N,2-N-dimethyl-3-methyliminopent-4-ene-1,2-diamine
CID 123196625
N-methyl-4-methyliminohex-5-en-3-amine
CID 123612125
4-N-hexan-2-ylhex-5-ene-2,4-diimine
CID 123670122
2-(Hept-6-en-3-ylideneamino)butan-1-amine
CID 123875746
(Z)-3-propan-2-yliminopent-1-en-1-amine
CID 130193662
2-(But-3-en-2-ylideneamino)ethanamine
CID 138507977
3-N-methyl-4-N-propan-2-ylhexa-1,5-diene-3,4-diimine
CID 138510684
(Z)-3-methyliminohept-4-en-1-amine
CID 142093160
(4Z)-3-methyliminohepta-4,6-dien-1-amine;molecular hydrogen
CID 143115330
ethane;(Z)-3-ethenyliminopent-1-en-1-amine
CID 143588496

Frequently Asked Questions

What is the IUPAC name of ethene;3-methyliminopent-4-en-1-amine?
The IUPAC name of ethene;3-methyliminopent-4-en-1-amine (CID 144855770) is ethene;3-methyliminopent-4-en-1-amine.
What is the SMILES notation for ethene;3-methyliminopent-4-en-1-amine?
The canonical SMILES for ethene;3-methyliminopent-4-en-1-amine is C=C.C=C/C(CCN)=N\C.
What is the InChIKey of ethene;3-methyliminopent-4-en-1-amine?
The InChIKey is UCJRVSDLMMFNIZ-WVLIHFOGSA-N. The full InChI is InChI=1S/C6H12N2.C2H4/c1-3-6(8-2)4-5-7;1-2/h3H,1,4-5,7H2,2H3;1-2H2/b8-6+;.
What are the key properties of ethene;3-methyliminopent-4-en-1-amine?
ethene;3-methyliminopent-4-en-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;3-methyliminopent-4-en-1-amine is sourced from PubChem (CID 144855770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).