1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine

C17H25NO2 — CID 114731151

IUPAC1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine
SMILESCCCNC(c1cc2ccccc2o1)C(CCC)OC
InChIInChI=1S/C17H25NO2/c1-4-8-15(19-3)17(18-11-5-2)16-12-13-9-6-7-10-14(13)20-16/h6-7,9-10,12,15,17-18H,4-5,8,11H2,1-3H3
InChIKeyGSENIUJIXOGKDV-UHFFFAOYSA-N
MW275.39 g/mol
LogP4.29
Rot. Bonds8

About 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine

1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine (PubChem CID 114731151) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine
PubChem CID114731151
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine
SMILESCCCNC(c1cc2ccccc2o1)C(CCC)OC
InChIInChI=1S/C17H25NO2/c1-4-8-15(19-3)17(18-11-5-2)16-12-13-9-6-7-10-14(13)20-16/h6-7,9-10,12,15,17-18H,4-5,8,11H2,1-3H3
InChIKeyGSENIUJIXOGKDV-UHFFFAOYSA-N
XLogP4.29
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-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-benzofuran-2-yl)-2-methoxy-3-methyl-N-propylbutan-1-amine
CID 114731176
N-ethyl-1-(7-fluoro-1-benzofuran-2-yl)-2-methoxypentan-1-amine
CID 114731148
2-methoxy-1-(4-methoxyphenyl)-N-propylpentan-1-amine
CID 116719309
1-(2,6-difluorophenyl)-2-methoxy-N-propylpentan-1-amine
CID 116719530
1-(3-ethylphenyl)-2-methoxy-N-propylpentan-1-amine
CID 116719527
1-(1-benzofuran-2-yl)-3,3,3-trifluoro-N-propylpropan-1-amine
CID 114728050
2-methoxy-1-(4-propan-2-ylphenyl)-N-propylpentan-1-amine
CID 116719339
N-[1-benzofuran-2-yl(pyridin-2-yl)methyl]propan-1-amine
CID 114727718
[1-(1-benzofuran-2-yl)-2-methoxypropyl]hydrazine
CID 105247149
1-(3,4-difluorophenyl)-2-methoxy-N-propylpentan-1-amine
CID 116719516
1-isoquinolin-8-yl-2-methoxy-N-propylpentan-1-amine
CID 103143800
N-[1-benzofuran-2-yl(2,3-dihydrofuran-5-yl)methyl]propan-1-amine
CID 102651524

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine?
The IUPAC name of 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine (CID 114731151) is 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine?
The canonical SMILES for 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine is CCCNC(c1cc2ccccc2o1)C(CCC)OC.
What is the InChIKey of 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine?
The InChIKey is GSENIUJIXOGKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-4-8-15(19-3)17(18-11-5-2)16-12-13-9-6-7-10-14(13)20-16/h6-7,9-10,12,15,17-18H,4-5,8,11H2,1-3H3.
What are the key properties of 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine?
1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine has a molecular weight of 275.39 g/mol, XLogP of 4.29, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-2-methoxy-N-propylpentan-1-amine is sourced from PubChem (CID 114731151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).