N-methoxy-N-methyl-2-propoxyethanamine

C7H17NO2 — CID 148644007

IUPACN-methoxy-N-methyl-2-propoxyethanamine
SMILESCCCOCCN(C)OC
InChIInChI=1S/C7H17NO2/c1-4-6-10-7-5-8(2)9-3/h4-7H2,1-3H3
InChIKeyNKPGVIRNTUEXGK-UHFFFAOYSA-N
MW147.22 g/mol
LogP0.91
Rot. Bonds6

About N-methoxy-N-methyl-2-propoxyethanamine

N-methoxy-N-methyl-2-propoxyethanamine (PubChem CID 148644007) has the molecular formula C7H17NO2 and a molecular weight of 147.22 g/mol. Its IUPAC name is N-methoxy-N-methyl-2-propoxyethanamine.

Molecular Properties

Compound NameN-methoxy-N-methyl-2-propoxyethanamine
PubChem CID148644007
Molecular FormulaC7H17NO2
Molecular Weight147.22 g/mol
Exact Mass147.13
IUPAC NameN-methoxy-N-methyl-2-propoxyethanamine
SMILESCCCOCCN(C)OC
InChIInChI=1S/C7H17NO2/c1-4-6-10-7-5-8(2)9-3/h4-7H2,1-3H3
InChIKeyNKPGVIRNTUEXGK-UHFFFAOYSA-N
XLogP0.91
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-methoxy-N-methyl-2-prop-2-enoxyethanamine
CID 131107830
N,N-difluoro-2-propoxyethanamine
CID 88791900
N-methoxy-N-methylhexan-1-amine
CID 54431715
1-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 88861501
N,N-dimethylpropan-1-amine;ethane;1-(2-methoxyethoxy)propane
CID 144952845
ethane;propane;1-propoxypropane
CID 143757970
N,N'-dimethyl-N-pentyl-N'-[2-(2-propoxyethoxy)ethyl]ethane-1,2-diamine
CID 167513119
1-methoxy-2-(2-methoxyethoxy)ethane;1-propoxypropane
CID 160614249
2-chloro-3-methoxy-N-methyl-N-(2-propoxyethyl)propan-1-amine
CID 106457635
N'-methyl-N'-(2-propoxyethyl)-N-propylethane-1,2-diamine
CID 106453516
1-ethoxypropane;methane
CID 158784820
1-propoxy-3-(3-propoxypropoxy)propane
CID 90943526

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-2-propoxyethanamine?
The IUPAC name of N-methoxy-N-methyl-2-propoxyethanamine (CID 148644007) is N-methoxy-N-methyl-2-propoxyethanamine.
What is the SMILES notation for N-methoxy-N-methyl-2-propoxyethanamine?
The canonical SMILES for N-methoxy-N-methyl-2-propoxyethanamine is CCCOCCN(C)OC.
What is the InChIKey of N-methoxy-N-methyl-2-propoxyethanamine?
The InChIKey is NKPGVIRNTUEXGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2/c1-4-6-10-7-5-8(2)9-3/h4-7H2,1-3H3.
What are the key properties of N-methoxy-N-methyl-2-propoxyethanamine?
N-methoxy-N-methyl-2-propoxyethanamine has a molecular weight of 147.22 g/mol, XLogP of 0.91, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-2-propoxyethanamine is sourced from PubChem (CID 148644007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).