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

C10H16N2 — CID 171555082

IUPAC(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide
SMILESC=C/C(=C/C(=N/C)NC)C(=C)C
InChIInChI=1S/C10H16N2/c1-6-9(8(2)3)7-10(11-4)12-5/h6-7H,1-2H2,3-5H3,(H,11,12)/b9-7-
InChIKeyWWCLZTPKLHBJIR-CLFYSBASSA-N
MW164.25 g/mol
LogP1.92
Rot. Bonds3

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

(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide (PubChem CID 171555082) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide.

Molecular Properties

Compound Name(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide
PubChem CID171555082
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide
SMILESC=C/C(=C/C(=N/C)NC)C(=C)C
InChIInChI=1S/C10H16N2/c1-6-9(8(2)3)7-10(11-4)12-5/h6-7H,1-2H2,3-5H3,(H,11,12)/b9-7-
InChIKeyWWCLZTPKLHBJIR-CLFYSBASSA-N
XLogP1.92
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.92
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': '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 (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
The IUPAC name of (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide (CID 171555082) is (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide.
What is the SMILES notation for (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
The canonical SMILES for (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide is C=C/C(=C/C(=N/C)NC)C(=C)C.
What is the InChIKey of (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
The InChIKey is WWCLZTPKLHBJIR-CLFYSBASSA-N. The full InChI is InChI=1S/C10H16N2/c1-6-9(8(2)3)7-10(11-4)12-5/h6-7H,1-2H2,3-5H3,(H,11,12)/b9-7-.
What are the key properties of (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide?
(2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide has a molecular weight of 164.25 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-3-ethenyl-N,N',4-trimethylpenta-2,4-dienimidamide is sourced from PubChem (CID 171555082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).