(2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine

C11H20N2 — CID 163966119

IUPAC(2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine
SMILESCCC(=C/C(C)=N/C)/C=C(/C)NC
InChIInChI=1S/C11H20N2/c1-6-11(7-9(2)12-4)8-10(3)13-5/h7-8,12H,6H2,1-5H3/b9-7-,11-8-,13-10+
InChIKeySLXNFUZXZKAVFE-JSTMGVOJSA-N
MW180.29 g/mol
LogP2.54
Rot. Bonds4

About (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine

(2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine (PubChem CID 163966119) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine.

Molecular Properties

Compound Name(2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine
PubChem CID163966119
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name(2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine
SMILESCCC(=C/C(C)=N/C)/C=C(/C)NC
InChIInChI=1S/C11H20N2/c1-6-11(7-9(2)12-4)8-10(3)13-5/h7-8,12H,6H2,1-5H3/b9-7-,11-8-,13-10+
InChIKeySLXNFUZXZKAVFE-JSTMGVOJSA-N
XLogP2.54
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.54
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

2-(Methylamino)-4-(methylimino)-pentene-2
CID 14983634
(Z)-N-ethyl-4-ethyliminopent-2-en-2-amine
CID 22857106
N-Methyl-4-(methylimino)-2-penten-2-amine
CID 72320248
(E)-N-methyl-4-methyliminopent-2-en-2-amine
CID 19374182
N,4-dimethyl-10-methyliminoundeca-2,4,6,8-tetraen-2-amine
CID 53962751
N,4,5,6,7,8-hexamethyl-10-methyliminoundeca-2,4,6,8-tetraen-2-amine
CID 54531433
methyl-[(3E,5E)-6-(methylamino)hepta-3,5-dien-2-ylidene]azanium
CID 57895519
[6-(Ethylamino)-4-propylhepta-3,5-dien-2-ylidene]-methylazanium
CID 59120193
N,4-dimethyl-6-methyliminohepta-2,4-dien-2-amine
CID 59886162
Methyl-[4-methyl-6-(methylamino)hepta-3,5-dien-2-ylidene]azanium
CID 59957987
N,3-dimethyl-4-methyliminocyclohexa-1,5-dien-1-amine
CID 67679348
N-ethyl-4-ethyliminopent-2-en-2-amine
CID 72526443

Frequently Asked Questions

What is the IUPAC name of (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine?
The IUPAC name of (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine (CID 163966119) is (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine.
What is the SMILES notation for (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine?
The canonical SMILES for (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine is CCC(=C/C(C)=N/C)/C=C(/C)NC.
What is the InChIKey of (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine?
The InChIKey is SLXNFUZXZKAVFE-JSTMGVOJSA-N. The full InChI is InChI=1S/C11H20N2/c1-6-11(7-9(2)12-4)8-10(3)13-5/h7-8,12H,6H2,1-5H3/b9-7-,11-8-,13-10+.
What are the key properties of (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine?
(2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine has a molecular weight of 180.29 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z)-4-ethyl-N-methyl-6-methyliminohepta-2,4-dien-2-amine is sourced from PubChem (CID 163966119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).