2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine

C10H23NO — CID 139652134

IUPAC2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine
SMILESCOCC(CN)(C(C)C)C(C)C
InChIInChI=1S/C10H23NO/c1-8(2)10(6-11,7-12-5)9(3)4/h8-9H,6-7,11H2,1-5H3
InChIKeyDUFGGLHIAOXSSI-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.89
Rot. Bonds5

About 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine

2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine (PubChem CID 139652134) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine
PubChem CID139652134
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine
SMILESCOCC(CN)(C(C)C)C(C)C
InChIInChI=1S/C10H23NO/c1-8(2)10(6-11,7-12-5)9(3)4/h8-9H,6-7,11H2,1-5H3
InChIKeyDUFGGLHIAOXSSI-UHFFFAOYSA-N
XLogP1.89
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(methoxymethyl)-2,4-dimethyl-3-(propoxymethyl)pentane
CID 22372611
2-cyclopentyl-2-(methoxymethyl)-3-methylbutan-1-amine
CID 139927528
2-(methoxymethyl)-2-propan-2-yldecan-1-amine
CID 139968822
3,3-bis(methoxymethyl)-2,6-dimethylheptane;3,3-bis(methoxymethyl)-2,4-dimethylpentane
CID 22373213
3-methoxy-3-(methoxymethyl)-2,4-dimethylpentane
CID 23384967
3,5-diethyl-4,4-bis(methoxymethyl)heptane
CID 90169994
(2R)-3-methoxy-2-methylpropane-1,2-diamine
CID 94474940
4-amino-1-methoxy-2-(methoxymethyl)-3-methylbutan-2-ol
CID 165443184
2-N-but-3-yn-2-yl-2-(methoxymethyl)-3-methylbutane-1,2-diamine
CID 114416278
3,3-bis(methoxymethyl)-2-methylpentane
CID 89106557
4-amino-1-methoxy-2,3-dimethylbutan-2-ol
CID 79136033
2-(methoxymethyl)-2-(2-methylpropyl)decan-1-amine
CID 139968873

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine?
The IUPAC name of 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine (CID 139652134) is 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine is COCC(CN)(C(C)C)C(C)C.
What is the InChIKey of 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine?
The InChIKey is DUFGGLHIAOXSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-8(2)10(6-11,7-12-5)9(3)4/h8-9H,6-7,11H2,1-5H3.
What are the key properties of 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine?
2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine has a molecular weight of 173.30 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-3-methyl-2-propan-2-ylbutan-1-amine is sourced from PubChem (CID 139652134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).