(1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine

C10H16N2 — CID 129312448

IUPAC(1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine
SMILESC=C(C)C(/C=C\C)=C(N)\N=C/C
InChIInChI=1S/C10H16N2/c1-5-7-9(8(3)4)10(11)12-6-2/h5-7H,3,11H2,1-2,4H3/b7-5-,10-9-,12-6-
InChIKeyORTXPENDNKPQHF-CHEVCYPZSA-N
MW164.25 g/mol
LogP2.40
Rot. Bonds3

About (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine

(1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine (PubChem CID 129312448) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine
PubChem CID129312448
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine
SMILESC=C(C)C(/C=C\C)=C(N)\N=C/C
InChIInChI=1S/C10H16N2/c1-5-7-9(8(3)4)10(11)12-6-2/h5-7H,3,11H2,1-2,4H3/b7-5-,10-9-,12-6-
InChIKeyORTXPENDNKPQHF-CHEVCYPZSA-N
XLogP2.40
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(E)-[(2E)-3,7-dimethylocta-2,6-dienylidene]amino]methanediamine
CID 118719543
(1Z,3E)-3-ethyl-1-(ethylideneamino)-5,5,5-trifluoropenta-1,3-dien-1-amine
CID 174086267
[[(2E)-3,7-dimethylocta-2,6-dienylidene]amino]methanediamine
CID 172018331
benzene;5-methyl-3H-pyridin-3-id-6-amine;yttrium
CID 59190356
2-Cyclohexa-2,4-dien-1-ylideneimidazole
CID 70629609
(2Z,4E,6E,8Z)-N,N',4,7-tetramethyldeca-2,4,6,8-tetraene-1,10-diimine
CID 89369382
(Z)-N'-ethyl-N-methyl-4,5-dimethylidenehex-2-ene-1,6-diimine
CID 89672783
(2Z,6Z)-3,6-bis[(Z)-prop-1-enyl]octa-2,6-diene-1,8-diimine
CID 89805399
3-ethenyl-N-methyl-4-[2-(methylideneamino)ethenyl]hexa-2,4-dien-1-imine
CID 90884099
N,3-bis(ethenyl)-N'-methyl-2-methylidenehex-3-ene-1,6-diimine
CID 90904084
N-(2-ethylhepta-1,3-dienyl)ethanimine
CID 91281205
3-ethenyl-N-methyl-4-methylidene-N'-prop-1-enylpent-2-ene-1,5-diimine
CID 91546937

Frequently Asked Questions

What is the IUPAC name of (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine?
The IUPAC name of (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine (CID 129312448) is (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine is C=C(C)C(/C=C\C)=C(N)\N=C/C.
What is the InChIKey of (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine?
The InChIKey is ORTXPENDNKPQHF-CHEVCYPZSA-N. The full InChI is InChI=1S/C10H16N2/c1-5-7-9(8(3)4)10(11)12-6-2/h5-7H,3,11H2,1-2,4H3/b7-5-,10-9-,12-6-.
What are the key properties of (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine?
(1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine has a molecular weight of 164.25 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z)-1-[(Z)-ethylideneamino]-2-prop-1-en-2-ylpenta-1,3-dien-1-amine is sourced from PubChem (CID 129312448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).