(Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine

C11H20N2 — CID 142498983

IUPAC(Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine
SMILESCCN/C=C(C)\N=C\C=C\C(C)C
InChIInChI=1S/C11H20N2/c1-5-12-9-11(4)13-8-6-7-10(2)3/h6-10,12H,5H2,1-4H3/b7-6+,11-9-,13-8+
InChIKeyRWQNILUZDIMYCO-RNIABJTASA-N
MW180.29 g/mol
LogP2.74
Rot. Bonds5

About (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine

(Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine (PubChem CID 142498983) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine
PubChem CID142498983
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name(Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine
SMILESCCN/C=C(C)\N=C\C=C\C(C)C
InChIInChI=1S/C11H20N2/c1-5-12-9-11(4)13-8-6-7-10(2)3/h6-10,12H,5H2,1-4H3/b7-6+,11-9-,13-8+
InChIKeyRWQNILUZDIMYCO-RNIABJTASA-N
XLogP2.74
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine?
The IUPAC name of (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine (CID 142498983) is (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine.
What is the SMILES notation for (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine?
The canonical SMILES for (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine is CCN/C=C(C)\N=C\C=C\C(C)C.
What is the InChIKey of (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine?
The InChIKey is RWQNILUZDIMYCO-RNIABJTASA-N. The full InChI is InChI=1S/C11H20N2/c1-5-12-9-11(4)13-8-6-7-10(2)3/h6-10,12H,5H2,1-4H3/b7-6+,11-9-,13-8+.
What are the key properties of (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine?
(Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine has a molecular weight of 180.29 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-2-[[(E)-4-methylpent-2-enylidene]amino]prop-1-en-1-amine is sourced from PubChem (CID 142498983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).