(Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine

C12H24N2 — CID 135230098

IUPAC(Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine
SMILESC/C=C(/C(C)C)N(CC)/N=C\CCC
InChIInChI=1S/C12H24N2/c1-6-9-10-13-14(8-3)12(7-2)11(4)5/h7,10-11H,6,8-9H2,1-5H3/b12-7-,13-10-
InChIKeyYENBSVXBPDXXFU-UCFQQYFPSA-N
MW196.34 g/mol
LogP3.65
Rot. Bonds6

About (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine

(Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine (PubChem CID 135230098) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine.

Molecular Properties

Compound Name(Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine
PubChem CID135230098
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name(Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine
SMILESC/C=C(/C(C)C)N(CC)/N=C\CCC
InChIInChI=1S/C12H24N2/c1-6-9-10-13-14(8-3)12(7-2)11(4)5/h7,10-11H,6,8-9H2,1-5H3/b12-7-,13-10-
InChIKeyYENBSVXBPDXXFU-UCFQQYFPSA-N
XLogP3.65
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine?
The IUPAC name of (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine (CID 135230098) is (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine.
What is the SMILES notation for (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine?
The canonical SMILES for (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine is C/C=C(/C(C)C)N(CC)/N=C\CCC.
What is the InChIKey of (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine?
The InChIKey is YENBSVXBPDXXFU-UCFQQYFPSA-N. The full InChI is InChI=1S/C12H24N2/c1-6-9-10-13-14(8-3)12(7-2)11(4)5/h7,10-11H,6,8-9H2,1-5H3/b12-7-,13-10-.
What are the key properties of (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine?
(Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine has a molecular weight of 196.34 g/mol, XLogP of 3.65, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(Z)-butylideneamino]-N-ethyl-4-methylpent-2-en-3-amine is sourced from PubChem (CID 135230098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).