N-tert-butyl-2,3-dimethylbutan-1-imine

C10H21N — CID 148774649

IUPACN-tert-butyl-2,3-dimethylbutan-1-imine
SMILESCC(C)C(C)/C=N/C(C)(C)C
InChIInChI=1S/C10H21N/c1-8(2)9(3)7-11-10(4,5)6/h7-9H,1-6H3/b11-7+
InChIKeyOJCJVHYXEBARNC-YRNVUSSQSA-N
MW155.28 g/mol
LogP3.15
Rot. Bonds2

About N-tert-butyl-2,3-dimethylbutan-1-imine

N-tert-butyl-2,3-dimethylbutan-1-imine (PubChem CID 148774649) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N-tert-butyl-2,3-dimethylbutan-1-imine.

Molecular Properties

Compound NameN-tert-butyl-2,3-dimethylbutan-1-imine
PubChem CID148774649
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN-tert-butyl-2,3-dimethylbutan-1-imine
SMILESCC(C)C(C)/C=N/C(C)(C)C
InChIInChI=1S/C10H21N/c1-8(2)9(3)7-11-10(4,5)6/h7-9H,1-6H3/b11-7+
InChIKeyOJCJVHYXEBARNC-YRNVUSSQSA-N
XLogP3.15
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 53.15
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 N-tert-butyl-2,3-dimethylbutan-1-imine?
The IUPAC name of N-tert-butyl-2,3-dimethylbutan-1-imine (CID 148774649) is N-tert-butyl-2,3-dimethylbutan-1-imine.
What is the SMILES notation for N-tert-butyl-2,3-dimethylbutan-1-imine?
The canonical SMILES for N-tert-butyl-2,3-dimethylbutan-1-imine is CC(C)C(C)/C=N/C(C)(C)C.
What is the InChIKey of N-tert-butyl-2,3-dimethylbutan-1-imine?
The InChIKey is OJCJVHYXEBARNC-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H21N/c1-8(2)9(3)7-11-10(4,5)6/h7-9H,1-6H3/b11-7+.
What are the key properties of N-tert-butyl-2,3-dimethylbutan-1-imine?
N-tert-butyl-2,3-dimethylbutan-1-imine has a molecular weight of 155.28 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2,3-dimethylbutan-1-imine is sourced from PubChem (CID 148774649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).