1-methoxy-N,N-dimethylbutan-2-amine

C7H17NO — CID 45087490

IUPAC1-methoxy-N,N-dimethylbutan-2-amine
SMILESCCC(COC)N(C)C
InChIInChI=1S/C7H17NO/c1-5-7(6-9-4)8(2)3/h7H,5-6H2,1-4H3
InChIKeyYABJQYZJFDJJSK-UHFFFAOYSA-N
MW131.22 g/mol
LogP0.97
Rot. Bonds4

About 1-methoxy-N,N-dimethylbutan-2-amine

1-methoxy-N,N-dimethylbutan-2-amine (PubChem CID 45087490) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is 1-methoxy-N,N-dimethylbutan-2-amine.

Molecular Properties

Compound Name1-methoxy-N,N-dimethylbutan-2-amine
PubChem CID45087490
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC Name1-methoxy-N,N-dimethylbutan-2-amine
SMILESCCC(COC)N(C)C
InChIInChI=1S/C7H17NO/c1-5-7(6-9-4)8(2)3/h7H,5-6H2,1-4H3
InChIKeyYABJQYZJFDJJSK-UHFFFAOYSA-N
XLogP0.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methoxyethylpropylmethylamine
CID 21948265
1-Ethoxypropan-2-yl(trimethyl)azanium iodide
CID 90679391
Isopropyl-(2-methoxy-ethyl)-methyl-amine
CID 239832
Diisopropyl-(2-methoxy-ethyl)-amine
CID 20079969
Ethyl-isopropyl-(2-methoxy-ethyl)-amine
CID 23559570
Isopropyl-(2-methoxy-ethyl)-propyl-amine
CID 23559583
1-ethoxy-3-fluoro-N,N-dimethylpropan-2-amine
CID 123524742
3-fluoro-N-(2-methoxyethyl)-N-propan-2-ylpropan-1-amine
CID 143070864
2-Diisopropylaminoethyl ethyl ether
CID 575118
N-propan-2-yl-N-(2-propoxyethyl)propan-2-amine
CID 85776061
Dimethylaminopropylather
CID 129648688
1-Ethoxypropan-2-yl(trimethyl)azanium
CID 90679392

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N,N-dimethylbutan-2-amine?
The IUPAC name of 1-methoxy-N,N-dimethylbutan-2-amine (CID 45087490) is 1-methoxy-N,N-dimethylbutan-2-amine.
What is the SMILES notation for 1-methoxy-N,N-dimethylbutan-2-amine?
The canonical SMILES for 1-methoxy-N,N-dimethylbutan-2-amine is CCC(COC)N(C)C.
What is the InChIKey of 1-methoxy-N,N-dimethylbutan-2-amine?
The InChIKey is YABJQYZJFDJJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO/c1-5-7(6-9-4)8(2)3/h7H,5-6H2,1-4H3.
What are the key properties of 1-methoxy-N,N-dimethylbutan-2-amine?
1-methoxy-N,N-dimethylbutan-2-amine has a molecular weight of 131.22 g/mol, XLogP of 0.97, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N,N-dimethylbutan-2-amine is sourced from PubChem (CID 45087490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).