(E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine

C11H21NO — CID 127004590

IUPAC(E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine
SMILESC/C(=N\OC(C)(C)C)C1CC1(C)C
InChIInChI=1S/C11H21NO/c1-8(9-7-11(9,5)6)12-13-10(2,3)4/h9H,7H2,1-6H3/b12-8+
InChIKeyMCNDECZRXKCWCQ-XYOKQWHBSA-N
MW183.29 g/mol
LogP3.22
Rot. Bonds2

About (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine

(E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine (PubChem CID 127004590) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine.

Molecular Properties

Compound Name(E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine
PubChem CID127004590
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine
SMILESC/C(=N\OC(C)(C)C)C1CC1(C)C
InChIInChI=1S/C11H21NO/c1-8(9-7-11(9,5)6)12-13-10(2,3)4/h9H,7H2,1-6H3/b12-8+
InChIKeyMCNDECZRXKCWCQ-XYOKQWHBSA-N
XLogP3.22
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 53.22
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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Related Compounds

CID 100937333
CID 100937333
2-[(2-methylpropan-2-yl)oxyimino]-3-oxobutanoic acid
CID 56624878
CID 100937332
CID 100937332
tert-butyl 2-acetyl-2-methylcyclopropane-1-carboxylate
CID 59593712
2-[(2-methylpropan-2-yl)oxyimino]propanedioic acid
CID 88615209
tert-butyl 1-methyl-2-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
CID 141102764
2,2,4-trimethoxy-5,5-dimethylcyclohexan-1-ol
CID 164668290
(1R)-2,2-dimethylcyclopropane-1-carbonyl chloride
CID 28875815
1,1-dimethyl-2-(2-methylprop-1-enyl)cyclopropane
CID 520632
tert-butyl (4S)-4-hydroxy-3,3-dimethylpyrrolidine-1-carboxylate
CID 118369273
tert-butyl N-(2,2-dimethylcyclopropyl)carbamate
CID 65142866
[(Z)-1-[(1S,2S)-2-tert-butyl-2-methylcyclopropyl]ethylideneamino]urea
CID 5405593

Frequently Asked Questions

What is the IUPAC name of (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine?
The IUPAC name of (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine (CID 127004590) is (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine.
What is the SMILES notation for (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine?
The canonical SMILES for (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine is C/C(=N\OC(C)(C)C)C1CC1(C)C.
What is the InChIKey of (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine?
The InChIKey is MCNDECZRXKCWCQ-XYOKQWHBSA-N. The full InChI is InChI=1S/C11H21NO/c1-8(9-7-11(9,5)6)12-13-10(2,3)4/h9H,7H2,1-6H3/b12-8+.
What are the key properties of (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine?
(E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine has a molecular weight of 183.29 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(2,2-dimethylcyclopropyl)-N-[(2-methylpropan-2-yl)oxy]ethanimine is sourced from PubChem (CID 127004590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).