N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine

C10H20N2O — CID 58320130

IUPACN,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine
SMILESC/N=C(\N1CCOCC1)C(C)(C)C
InChIInChI=1S/C10H20N2O/c1-10(2,3)9(11-4)12-5-7-13-8-6-12/h5-8H2,1-4H3/b11-9-
InChIKeyXQGLEGFFMNVZIM-LUAWRHEFSA-N
MW184.28 g/mol
LogP1.39
Rot. Bonds

About N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine

N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine (PubChem CID 58320130) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine.

Molecular Properties

Compound NameN,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine
PubChem CID58320130
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine
SMILESC/N=C(\N1CCOCC1)C(C)(C)C
InChIInChI=1S/C10H20N2O/c1-10(2,3)9(11-4)12-5-7-13-8-6-12/h5-8H2,1-4H3/b11-9-
InChIKeyXQGLEGFFMNVZIM-LUAWRHEFSA-N
XLogP1.39
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine?
The IUPAC name of N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine (CID 58320130) is N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine.
What is the SMILES notation for N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine?
The canonical SMILES for N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine is C/N=C(\N1CCOCC1)C(C)(C)C.
What is the InChIKey of N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine?
The InChIKey is XQGLEGFFMNVZIM-LUAWRHEFSA-N. The full InChI is InChI=1S/C10H20N2O/c1-10(2,3)9(11-4)12-5-7-13-8-6-12/h5-8H2,1-4H3/b11-9-.
What are the key properties of N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine?
N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine has a molecular weight of 184.28 g/mol, XLogP of 1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-1-morpholin-4-ylpropan-1-imine is sourced from PubChem (CID 58320130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).