N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine

C14H30N2O2 — CID 62459646

IUPACN-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine
SMILESCN(C)CCOCC1CCC(CNC(C)(C)C)O1
InChIInChI=1S/C14H30N2O2/c1-14(2,3)15-10-12-6-7-13(18-12)11-17-9-8-16(4)5/h12-13,15H,6-11H2,1-5H3
InChIKeyMJJRPJYQJDYXTG-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.50
Rot. Bonds7

About N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine

N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 62459646) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID62459646
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC NameN-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine
SMILESCN(C)CCOCC1CCC(CNC(C)(C)C)O1
InChIInChI=1S/C14H30N2O2/c1-14(2,3)15-10-12-6-7-13(18-12)11-17-9-8-16(4)5/h12-13,15H,6-11H2,1-5H3
InChIKeyMJJRPJYQJDYXTG-UHFFFAOYSA-N
XLogP1.50
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[[5-(2-methoxyethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 55077944
N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]cyclopropanamine
CID 62459470
N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 66324414
2-methyl-N-[[5-(oxolan-3-ylmethoxymethyl)oxolan-2-yl]methyl]propan-2-amine
CID 62484891
2-methyl-N-[[5-[[methyl(propyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62417002
N-[[5-(cycloheptyloxymethyl)oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 62460585
N-[[5-[2-[cyclopropyl(methyl)amino]ethoxymethyl]oxolan-2-yl]methyl]cyclopropanamine
CID 102740842
N-methyl-N-[2-[[5-(propylaminomethyl)oxolan-2-yl]methoxy]ethyl]cyclopropanamine
CID 102741032
N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine
CID 62418705
N-methyl-N-[2-[[5-[(2-methylpropylamino)methyl]oxolan-2-yl]methoxy]ethyl]cyclopropanamine
CID 102740783
N-[[5-[(4-fluorophenoxy)methyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 62454144
2-methyl-N-[[5-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 112665944

Frequently Asked Questions

What is the IUPAC name of N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine (CID 62459646) is N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine is CN(C)CCOCC1CCC(CNC(C)(C)C)O1.
What is the InChIKey of N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is MJJRPJYQJDYXTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-14(2,3)15-10-12-6-7-13(18-12)11-17-9-8-16(4)5/h12-13,15H,6-11H2,1-5H3.
What are the key properties of N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine?
N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 258.41 g/mol, XLogP of 1.50, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[2-(dimethylamino)ethoxymethyl]oxolan-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62459646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).