(E)-N-tert-butyl-2-methylpent-2-en-1-imine

C10H19N — CID 10582977

IUPAC(E)-N-tert-butyl-2-methylpent-2-en-1-imine
SMILESCC/C=C(C)/C=N/C(C)(C)C
InChIInChI=1S/C10H19N/c1-6-7-9(2)8-11-10(3,4)5/h7-8H,6H2,1-5H3/b9-7+,11-8+
InChIKeyRZEQXVADSXQDIO-BIZFVBGRSA-N
MW153.27 g/mol
LogP3.21
Rot. Bonds2

About (E)-N-tert-butyl-2-methylpent-2-en-1-imine

(E)-N-tert-butyl-2-methylpent-2-en-1-imine (PubChem CID 10582977) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (E)-N-tert-butyl-2-methylpent-2-en-1-imine.

Molecular Properties

Compound Name(E)-N-tert-butyl-2-methylpent-2-en-1-imine
PubChem CID10582977
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(E)-N-tert-butyl-2-methylpent-2-en-1-imine
SMILESCC/C=C(C)/C=N/C(C)(C)C
InChIInChI=1S/C10H19N/c1-6-7-9(2)8-11-10(3,4)5/h7-8H,6H2,1-5H3/b9-7+,11-8+
InChIKeyRZEQXVADSXQDIO-BIZFVBGRSA-N
XLogP3.21
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (E)-N-tert-butyl-2-methylpent-2-en-1-imine?
The IUPAC name of (E)-N-tert-butyl-2-methylpent-2-en-1-imine (CID 10582977) is (E)-N-tert-butyl-2-methylpent-2-en-1-imine.
What is the SMILES notation for (E)-N-tert-butyl-2-methylpent-2-en-1-imine?
The canonical SMILES for (E)-N-tert-butyl-2-methylpent-2-en-1-imine is CC/C=C(C)/C=N/C(C)(C)C.
What is the InChIKey of (E)-N-tert-butyl-2-methylpent-2-en-1-imine?
The InChIKey is RZEQXVADSXQDIO-BIZFVBGRSA-N. The full InChI is InChI=1S/C10H19N/c1-6-7-9(2)8-11-10(3,4)5/h7-8H,6H2,1-5H3/b9-7+,11-8+.
What are the key properties of (E)-N-tert-butyl-2-methylpent-2-en-1-imine?
(E)-N-tert-butyl-2-methylpent-2-en-1-imine has a molecular weight of 153.27 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-tert-butyl-2-methylpent-2-en-1-imine is sourced from PubChem (CID 10582977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).