1-methoxy-N,N-dimethylpropan-1-amine

C6H15NO — CID 22062441

IUPAC1-methoxy-N,N-dimethylpropan-1-amine
SMILESCCC(OC)N(C)C
InChIInChI=1S/C6H15NO/c1-5-6(8-4)7(2)3/h6H,5H2,1-4H3
InChIKeyMCAWHDASPIOXKO-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.93
Rot. Bonds3

About 1-methoxy-N,N-dimethylpropan-1-amine

1-methoxy-N,N-dimethylpropan-1-amine (PubChem CID 22062441) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is 1-methoxy-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name1-methoxy-N,N-dimethylpropan-1-amine
PubChem CID22062441
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name1-methoxy-N,N-dimethylpropan-1-amine
SMILESCCC(OC)N(C)C
InChIInChI=1S/C6H15NO/c1-5-6(8-4)7(2)3/h6H,5H2,1-4H3
InChIKeyMCAWHDASPIOXKO-UHFFFAOYSA-N
XLogP0.93
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.93
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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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N,N-dimethylpropan-1-amine?
The IUPAC name of 1-methoxy-N,N-dimethylpropan-1-amine (CID 22062441) is 1-methoxy-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 1-methoxy-N,N-dimethylpropan-1-amine?
The canonical SMILES for 1-methoxy-N,N-dimethylpropan-1-amine is CCC(OC)N(C)C.
What is the InChIKey of 1-methoxy-N,N-dimethylpropan-1-amine?
The InChIKey is MCAWHDASPIOXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-5-6(8-4)7(2)3/h6H,5H2,1-4H3.
What are the key properties of 1-methoxy-N,N-dimethylpropan-1-amine?
1-methoxy-N,N-dimethylpropan-1-amine has a molecular weight of 117.19 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 22062441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).