ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide

C12H20N2 — CID 171555081

IUPACethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide
SMILESC=C.C=C/C(=C/C(=N/C)NC)C(=C)C
InChIInChI=1S/C10H16N2.C2H4/c1-6-9(8(2)3)7-10(11-4)12-5;1-2/h6-7H,1-2H2,3-5H3,(H,11,12);1-2H2/b9-7-;
InChIKeyJFWUCIPMUQRJKW-VILQZVERSA-N
MW192.31 g/mol
LogP2.72
Rot. Bonds3

About ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide

ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide (PubChem CID 171555081) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide.

Molecular Properties

Compound Nameethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide
PubChem CID171555081
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Nameethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide
SMILESC=C.C=C/C(=C/C(=N/C)NC)C(=C)C
InChIInChI=1S/C10H16N2.C2H4/c1-6-9(8(2)3)7-10(11-4)12-5;1-2/h6-7H,1-2H2,3-5H3,(H,11,12);1-2H2/b9-7-;
InChIKeyJFWUCIPMUQRJKW-VILQZVERSA-N
XLogP2.72
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[(1Z,3Z)-3-(1-amino-1-fluoroethyl)hepta-1,3-dienyl]-N'-methylethanimidamide
CID 177357033
N,N'-dimethylpent-2-enimidamide
CID 123169307
(2E,3Z)-2-ethylidene-N,N',5-trimethylhexa-3,5-dienimidamide
CID 123185969
N',4-dimethylpenta-2,4-dienimidamide
CID 123250461
(2E,3Z)-N-(1-aminoethylidene)-2-ethylidene-N'-methylhepta-3,5,6-trienimidamide
CID 123348002
9-Ethenyl-2,6-dimethyl-1,4,9,10-tetrahydro-1,3-diazecine
CID 123923845
(3Z)-5-amino-N,N',6-trimethylhepta-3,5-dienimidamide
CID 130372082
(Z)-N'-methyl-N-[N-methyl-C-[(Z)-(6-methylcyclohexa-2,4-dien-1-ylidene)methyl]carbonimidoyl]but-2-enimidamide
CID 132094701
(Z)-N'-methyl-4-methylidene-N-prop-1-en-2-ylhex-2-enimidamide
CID 132125351
N-ethenyl-N'-[(1Z,3E)-2-ethyl-3-methylhexa-1,3,5-trienyl]ethanimidamide
CID 132170857
N'-[(1Z,3E)-2,3-dimethylhexa-1,3,5-trienyl]-N-ethenylethanimidamide
CID 134214435
(3Z,5Z)-N'-methyl-7-methylidenenona-3,5-dienimidamide
CID 134286810

Frequently Asked Questions

What is the IUPAC name of ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
The IUPAC name of ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide (CID 171555081) is ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide.
What is the SMILES notation for ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
The canonical SMILES for ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide is C=C.C=C/C(=C/C(=N/C)NC)C(=C)C.
What is the InChIKey of ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
The InChIKey is JFWUCIPMUQRJKW-VILQZVERSA-N. The full InChI is InChI=1S/C10H16N2.C2H4/c1-6-9(8(2)3)7-10(11-4)12-5;1-2/h6-7H,1-2H2,3-5H3,(H,11,12);1-2H2/b9-7-;.
What are the key properties of ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide has a molecular weight of 192.31 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide is sourced from PubChem (CID 171555081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).