(2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine

C9H16N2 — CID 134185502

IUPAC(2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine
SMILESC=N/C=C\C=C(\C)N(C)CC
InChIInChI=1S/C9H16N2/c1-5-11(4)9(2)7-6-8-10-3/h6-8H,3,5H2,1-2,4H3/b8-6-,9-7-
InChIKeyGBPISQYXSORYHL-VRHVFUOLSA-N
MW152.24 g/mol
LogP2.06
Rot. Bonds4

About (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine

(2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine (PubChem CID 134185502) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine.

Molecular Properties

Compound Name(2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine
PubChem CID134185502
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine
SMILESC=N/C=C\C=C(\C)N(C)CC
InChIInChI=1S/C9H16N2/c1-5-11(4)9(2)7-6-8-10-3/h6-8H,3,5H2,1-2,4H3/b8-6-,9-7-
InChIKeyGBPISQYXSORYHL-VRHVFUOLSA-N
XLogP2.06
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.06
H-Bond Donors ≤ 50
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

(2E,4Z)-5-(methylideneamino)penta-2,4-dien-2-amine
CID 89331751
[(2Z,4Z)-5-(methylideneamino)penta-2,4-dien-2-yl]boronic acid
CID 146760706
N,N-dimethylethanamine;N-[(Z)-prop-1-enyl]methanimine
CID 143693608
N'-[1-[ethyl(methyl)amino]ethenyl]-N-methylidenemethanimidamide
CID 143488080
N-hexa-1,3-dienylmethanimine
CID 123963868
(2Z)-N,N-dimethyl-4-[(E)-2-(methylideneamino)ethenyl]iminohexa-2,5-dien-2-amine
CID 143342843
(4Z,7Z,10Z,13Z,16Z,19Z)-N-methyl-N-[2-[[(2E,4Z)-2-methyl-5-(methylideneamino)penta-2,4-dienoyl]amino]ethyl]docosa-4,7,10,13,16,19-hexaenamide
CID 129157094
N-[(1E,3Z)-4-(methylideneamino)buta-1,3-dienyl]acetamide
CID 143328534
(Z)-N-ethyl-3-imino-N-methyl-1-(methylideneamino)prop-1-en-1-amine
CID 90453488
N-[3-chloro-1-[(2E,4Z)-5-(methylideneamino)penta-2,4-dien-2-yl]pyrazol-4-yl]-N-methyl-2-methylsulfanylbutanamide
CID 130450444
(2R,4E,6Z)-2-amino-1-methoxy-4-methyl-7-(methylideneamino)hepta-4,6-dien-1-ol
CID 146559535
(2Z)-N'-ethenyl-N-ethyl-N-methylpenta-2,4-dienimidamide
CID 166999090

Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine?
The IUPAC name of (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine (CID 134185502) is (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine.
What is the SMILES notation for (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine?
The canonical SMILES for (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine is C=N/C=C\C=C(\C)N(C)CC.
What is the InChIKey of (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine?
The InChIKey is GBPISQYXSORYHL-VRHVFUOLSA-N. The full InChI is InChI=1S/C9H16N2/c1-5-11(4)9(2)7-6-8-10-3/h6-8H,3,5H2,1-2,4H3/b8-6-,9-7-.
What are the key properties of (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine?
(2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine has a molecular weight of 152.24 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-N-ethyl-N-methyl-5-(methylideneamino)penta-2,4-dien-2-amine is sourced from PubChem (CID 134185502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).