N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine

C11H23N — CID 118217255

IUPACN-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine
SMILESC/C(=N\C(C)(C)C(C)C)C(C)C
InChIInChI=1S/C11H23N/c1-8(2)10(5)12-11(6,7)9(3)4/h8-9H,1-7H3/b12-10+
InChIKeyYCNQZKRSWZTSIP-ZRDIBKRKSA-N
MW169.31 g/mol
LogP3.54
Rot. Bonds3

About N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine

N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine (PubChem CID 118217255) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine.

Molecular Properties

Compound NameN-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine
PubChem CID118217255
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine
SMILESC/C(=N\C(C)(C)C(C)C)C(C)C
InChIInChI=1S/C11H23N/c1-8(2)10(5)12-11(6,7)9(3)4/h8-9H,1-7H3/b12-10+
InChIKeyYCNQZKRSWZTSIP-ZRDIBKRKSA-N
XLogP3.54
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.54
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-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine?
The IUPAC name of N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine (CID 118217255) is N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine.
What is the SMILES notation for N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine?
The canonical SMILES for N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine is C/C(=N\C(C)(C)C(C)C)C(C)C.
What is the InChIKey of N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine?
The InChIKey is YCNQZKRSWZTSIP-ZRDIBKRKSA-N. The full InChI is InChI=1S/C11H23N/c1-8(2)10(5)12-11(6,7)9(3)4/h8-9H,1-7H3/b12-10+.
What are the key properties of N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine?
N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine has a molecular weight of 169.31 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutan-2-yl)-3-methylbutan-2-imine is sourced from PubChem (CID 118217255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).