1-ethoxy-N-methylethanamine

C5H13NO — CID 57089902

IUPAC1-ethoxy-N-methylethanamine
SMILESCCOC(C)NC
InChIInChI=1S/C5H13NO/c1-4-7-5(2)6-3/h5-6H,4H2,1-3H3
InChIKeySRNKZYOMNMSIRK-UHFFFAOYSA-N
MW103.16 g/mol
LogP0.59
Rot. Bonds3

About 1-ethoxy-N-methylethanamine

1-ethoxy-N-methylethanamine (PubChem CID 57089902) has the molecular formula C5H13NO and a molecular weight of 103.16 g/mol. Its IUPAC name is 1-ethoxy-N-methylethanamine.

Molecular Properties

Compound Name1-ethoxy-N-methylethanamine
PubChem CID57089902
Molecular FormulaC5H13NO
Molecular Weight103.16 g/mol
Exact Mass103.10
IUPAC Name1-ethoxy-N-methylethanamine
SMILESCCOC(C)NC
InChIInChI=1S/C5H13NO/c1-4-7-5(2)6-3/h5-6H,4H2,1-3H3
InChIKeySRNKZYOMNMSIRK-UHFFFAOYSA-N
XLogP0.59
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.16
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,1-diethoxyethane;N-methylmethanamine
CID 90073696
1-butoxy-N-methylethanamine;ethane
CID 144998639
1-(1-ethoxyethylamino)ethanol
CID 18004306
N-(1-ethoxyethyl)propan-1-amine
CID 23317827
1,1-diethoxy-N,3-dimethylbutan-2-amine
CID 12506255
1-ethoxyethylcyanamide
CID 55286094
1-ethoxyethanol;N-methylmethanamine
CID 18941772
2-ethoxy-N-methylhexan-3-amine
CID 64534795
3-(1-ethoxyethyl)-1,1-diethylthiourea
CID 15322499
1,1-diethoxyethane
CID 7765
1-ethoxy-N-methylethane-1,2-diamine
CID 146966482
2-ethoxy-2-(methylamino)ethanol
CID 57110099

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-methylethanamine?
The IUPAC name of 1-ethoxy-N-methylethanamine (CID 57089902) is 1-ethoxy-N-methylethanamine.
What is the SMILES notation for 1-ethoxy-N-methylethanamine?
The canonical SMILES for 1-ethoxy-N-methylethanamine is CCOC(C)NC.
What is the InChIKey of 1-ethoxy-N-methylethanamine?
The InChIKey is SRNKZYOMNMSIRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-4-7-5(2)6-3/h5-6H,4H2,1-3H3.
What are the key properties of 1-ethoxy-N-methylethanamine?
1-ethoxy-N-methylethanamine has a molecular weight of 103.16 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-methylethanamine is sourced from PubChem (CID 57089902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).