3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine

C14H25NO2 — CID 116727069

IUPAC3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine
SMILESCCCNC(Cc1ccoc1)C(C)(C)OCC
InChIInChI=1S/C14H25NO2/c1-5-8-15-13(14(3,4)17-6-2)10-12-7-9-16-11-12/h7,9,11,13,15H,5-6,8,10H2,1-4H3
InChIKeyKKCXJEDDPXVQBO-UHFFFAOYSA-N
MW239.36 g/mol
LogP3.01
Rot. Bonds8

About 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine

3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine (PubChem CID 116727069) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine.

Molecular Properties

Compound Name3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine
PubChem CID116727069
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine
SMILESCCCNC(Cc1ccoc1)C(C)(C)OCC
InChIInChI=1S/C14H25NO2/c1-5-8-15-13(14(3,4)17-6-2)10-12-7-9-16-11-12/h7,9,11,13,15H,5-6,8,10H2,1-4H3
InChIKeyKKCXJEDDPXVQBO-UHFFFAOYSA-N
XLogP3.01
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1,1-trifluoro-3-(furan-3-yl)-N-propylpropan-2-amine
CID 105030039
3-ethoxy-3-methyl-1-(1-methylpyrazol-4-yl)-N-propylbutan-2-amine
CID 116727085
4-[3-ethoxy-3-methyl-2-(propylamino)butyl]pyridin-2-amine
CID 116727253
2-ethoxy-1-(furan-3-yl)-2-methyl-N-propylbutan-1-amine
CID 116759332
2-ethoxy-2-methyl-N-propylpentan-3-amine
CID 116727014
3-ethoxy-3-methyl-N-propyl-1-pyridin-4-ylpentan-2-amine
CID 116759285
3-ethoxy-1-(4-fluorophenyl)-3-methyl-N-propylpentan-2-amine
CID 116759306
1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine
CID 116715979
N-[1-(4-ethoxyphenyl)-2-(furan-3-yl)ethyl]propan-1-amine
CID 105029819
1-(2,3-dichlorophenyl)-3-ethoxy-3-methyl-N-propylbutan-2-amine
CID 107309099
3-ethoxy-N-ethyl-1-(4-ethylphenyl)-3-methylbutan-2-amine
CID 116726891
3-ethoxy-3-ethyl-1-(4-methylphenyl)-N-propylpentan-2-amine
CID 116760344

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine?
The IUPAC name of 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine (CID 116727069) is 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine.
What is the SMILES notation for 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine?
The canonical SMILES for 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine is CCCNC(Cc1ccoc1)C(C)(C)OCC.
What is the InChIKey of 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine?
The InChIKey is KKCXJEDDPXVQBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-5-8-15-13(14(3,4)17-6-2)10-12-7-9-16-11-12/h7,9,11,13,15H,5-6,8,10H2,1-4H3.
What are the key properties of 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine?
3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine has a molecular weight of 239.36 g/mol, XLogP of 3.01, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine is sourced from PubChem (CID 116727069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).