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

C6H15NO — CID 547431

IUPAC3-methoxy-N,N-dimethylpropan-1-amine
SMILESCOCCCN(C)C
InChIInChI=1S/C6H15NO/c1-7(2)5-4-6-8-3/h4-6H2,1-3H3
InChIKeyVIVLBCLZNBHPGE-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.58
Rot. Bonds4

About 3-methoxy-N,N-dimethylpropan-1-amine

3-methoxy-N,N-dimethylpropan-1-amine (PubChem CID 547431) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is 3-methoxy-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-methoxy-N,N-dimethylpropan-1-amine
PubChem CID547431
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Name3-methoxy-N,N-dimethylpropan-1-amine
SMILESCOCCCN(C)C
InChIInChI=1S/C6H15NO/c1-7(2)5-4-6-8-3/h4-6H2,1-3H3
InChIKeyVIVLBCLZNBHPGE-UHFFFAOYSA-N
XLogP0.58
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

O-[3-(dimethylamino)propyl]hydroxylamine
CID 10630465
4-Methoxy-N,N-dimethylbut-2-yn-1-amine
CID 339027
3-Methyl-1,3-oxazinane
CID 641502
1-Propanamine, 3,3'-oxybis[N,N-dimethyl-
CID 12295923
3-Ethoxy-N,N-dimethylpropylamine
CID 91374
3-ethenoxy-N,N-dimethylpropan-1-amine
CID 11768595
1-methoxy-N,N-dimethylpropan-1-amine
CID 22062441
1-methoxy-N,N-dimethylethanamine
CID 22505825
Magnesium, bromo(1-(dimethylamino)-1-propanolato-kappaO)-
CID 116738
Trimethyl-[3-[3-(trimethylazaniumyl)propoxy]propyl]azanium
CID 46900
3-ethoxy-N-fluoro-N-methylpropan-1-amine
CID 154509635
N-ethyl-N-fluoro-3-methoxypropan-1-amine
CID 154513537

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-methoxy-N,N-dimethylpropan-1-amine (CID 547431) is 3-methoxy-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-methoxy-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-methoxy-N,N-dimethylpropan-1-amine is COCCCN(C)C.
What is the InChIKey of 3-methoxy-N,N-dimethylpropan-1-amine?
The InChIKey is VIVLBCLZNBHPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-7(2)5-4-6-8-3/h4-6H2,1-3H3.
What are the key properties of 3-methoxy-N,N-dimethylpropan-1-amine?
3-methoxy-N,N-dimethylpropan-1-amine has a molecular weight of 117.19 g/mol, XLogP of 0.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 547431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).