N-(2-methoxyethyl)propan-2-amine

C6H15NO — CID 551575

IUPACN-(2-methoxyethyl)propan-2-amine
SMILESCOCCNC(C)C
InChIInChI=1S/C6H15NO/c1-6(2)7-4-5-8-3/h6-7H,4-5H2,1-3H3
InChIKeyUMCVTLHNNUEZDO-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.63
Rot. Bonds4

About N-(2-methoxyethyl)propan-2-amine

N-(2-methoxyethyl)propan-2-amine (PubChem CID 551575) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is N-(2-methoxyethyl)propan-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)propan-2-amine
PubChem CID551575
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC NameN-(2-methoxyethyl)propan-2-amine
SMILESCOCCNC(C)C
InChIInChI=1S/C6H15NO/c1-6(2)7-4-5-8-3/h6-7H,4-5H2,1-3H3
InChIKeyUMCVTLHNNUEZDO-UHFFFAOYSA-N
XLogP0.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 7994
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(2-Methoxyethyl)(methyl)amine
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(3S)-3-methylmorpholine
CID 12012220
N-Methyloxetan-3-amine
CID 46839993
N-(2-methoxyethyl)cyclopropanamine
CID 18944978
N-(2-Methoxyethyl)ethylamine
CID 546877
N-tert-Butyl-2-methoxyethylamine
CID 559304

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)propan-2-amine?
The IUPAC name of N-(2-methoxyethyl)propan-2-amine (CID 551575) is N-(2-methoxyethyl)propan-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)propan-2-amine?
The canonical SMILES for N-(2-methoxyethyl)propan-2-amine is COCCNC(C)C.
What is the InChIKey of N-(2-methoxyethyl)propan-2-amine?
The InChIKey is UMCVTLHNNUEZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO/c1-6(2)7-4-5-8-3/h6-7H,4-5H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)propan-2-amine?
N-(2-methoxyethyl)propan-2-amine has a molecular weight of 117.19 g/mol, XLogP of 0.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)propan-2-amine is sourced from PubChem (CID 551575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).