N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine

C10H23NO — CID 123760807

IUPACN-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine
SMILESCCC(C)N(C)COC(C)(C)C
InChIInChI=1S/C10H23NO/c1-7-9(2)11(6)8-12-10(3,4)5/h9H,7-8H2,1-6H3
InChIKeyGDRPXEARAUDZGH-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.49
Rot. Bonds4

About N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine

N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine (PubChem CID 123760807) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine
PubChem CID123760807
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine
SMILESCCC(C)N(C)COC(C)(C)C
InChIInChI=1S/C10H23NO/c1-7-9(2)11(6)8-12-10(3,4)5/h9H,7-8H2,1-6H3
InChIKeyGDRPXEARAUDZGH-UHFFFAOYSA-N
XLogP2.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-methoxy-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]propan-2-amine
CID 123868125
N-ethyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine
CID 22960539
N-[(2-methylpropan-2-yl)oxymethyl]-N-propylpropan-1-amine
CID 123627264
ethanol;N-ethyl-N-methylbutan-2-amine
CID 88665747
N-(2,2-dimethoxyethyl)-N-methylbutan-2-amine
CID 66223820
N-butan-2-yl-N-methylbutan-2-amine;2-methylpropane-1,2-diol
CID 19889994
N'-butan-2-yl-N-[2-[butan-2-yl(methyl)amino]ethyl]-N,N'-dimethylethane-1,2-diamine
CID 159533219
4-[butan-2-yl(methyl)amino]-2,2-dimethylbutanenitrile
CID 65251542
2,2,2-trifluoro-N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]ethanamine
CID 163485226
1-[butan-2-yl(methyl)amino]-4,4-dimethylpentan-3-one
CID 62625289
2-ethoxy-2-methylpropane
CID 12512
2-ethoxy-2-(113C)methyl(1,3-13C2)propane
CID 71308925

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine?
The IUPAC name of N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine (CID 123760807) is N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine.
What is the SMILES notation for N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine?
The canonical SMILES for N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine is CCC(C)N(C)COC(C)(C)C.
What is the InChIKey of N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine?
The InChIKey is GDRPXEARAUDZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-7-9(2)11(6)8-12-10(3,4)5/h9H,7-8H2,1-6H3.
What are the key properties of N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine?
N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine has a molecular weight of 173.30 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-2-amine is sourced from PubChem (CID 123760807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).