ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide

C11H22N2 — CID 144981959

IUPACethane;N'-ethenyl-N-prop-2-enylideneethanimidamide
SMILESC=C/C=N/C(C)=N/C=C.CC.CC
InChIInChI=1S/C7H10N2.2C2H6/c1-4-6-9-7(3)8-5-2;2*1-2/h4-6H,1-2H2,3H3;2*1-2H3/b8-7+,9-6+;;
InChIKeyGFDGXXJYYGBYND-JPMDGWNPSA-N
MW182.31 g/mol
LogP3.86
Rot. Bonds2

About ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide

ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide (PubChem CID 144981959) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide.

Molecular Properties

Compound Nameethane;N'-ethenyl-N-prop-2-enylideneethanimidamide
PubChem CID144981959
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Nameethane;N'-ethenyl-N-prop-2-enylideneethanimidamide
SMILESC=C/C=N/C(C)=N/C=C.CC.CC
InChIInChI=1S/C7H10N2.2C2H6/c1-4-6-9-7(3)8-5-2;2*1-2/h4-6H,1-2H2,3H3;2*1-2H3/b8-7+,9-6+;;
InChIKeyGFDGXXJYYGBYND-JPMDGWNPSA-N
XLogP3.86
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide 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

butane;N-prop-1-en-2-ylprop-2-en-1-imine
CID 144787234
ethane;ethene;N-ethenylprop-2-en-1-imine
CID 145208086
ethane;ethenyl N-ethenylethanimidate
CID 143602013
N-(2-fluoro-4-methylpent-2-en-3-yl)prop-2-en-1-imine
CID 91152307
prop-2-enylidenecarbamic acid
CID 175459397
N-[5-(prop-2-enylideneamino)octa-1,3,5,7-tetraen-4-yl]prop-2-en-1-imine
CID 175480907
butane;ethane;N-ethenylbut-3-en-2-imine
CID 145149803
[2,2-dimethyl-1-(prop-2-enylideneamino)propylidene]tungsten
CID 171733590
1-methyl-3-prop-2-enylideneurea
CID 91455060
ethane;(Z)-N-prop-1-en-2-yloxyprop-2-en-1-imine
CID 143697946
ethane;(Z)-N-(methylideneamino)but-3-en-2-imine
CID 143330418
ethane;ethyl N-ethenylethanimidothioate
CID 143602053

Frequently Asked Questions

What is the IUPAC name of ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide?
The IUPAC name of ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide (CID 144981959) is ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide.
What is the SMILES notation for ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide?
The canonical SMILES for ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide is C=C/C=N/C(C)=N/C=C.CC.CC.
What is the InChIKey of ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide?
The InChIKey is GFDGXXJYYGBYND-JPMDGWNPSA-N. The full InChI is InChI=1S/C7H10N2.2C2H6/c1-4-6-9-7(3)8-5-2;2*1-2/h4-6H,1-2H2,3H3;2*1-2H3/b8-7+,9-6+;;.
What are the key properties of ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide?
ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide has a molecular weight of 182.31 g/mol, XLogP of 3.86, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N'-ethenyl-N-prop-2-enylideneethanimidamide is sourced from PubChem (CID 144981959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).