3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine

C17H26N2O2 — CID 86678629

IUPAC3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine
SMILESCN(C)CCC(c1ccc2c(c1)CCO2)C1CNCCO1
InChIInChI=1S/C17H26N2O2/c1-19(2)8-5-15(17-12-18-7-10-21-17)13-3-4-16-14(11-13)6-9-20-16/h3-4,11,15,17-18H,5-10,12H2,1-2H3
InChIKeyYQSUXLUWSZYCPY-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.65
Rot. Bonds5

About 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine

3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine (PubChem CID 86678629) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine.

Molecular Properties

Compound Name3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine
PubChem CID86678629
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine
SMILESCN(C)CCC(c1ccc2c(c1)CCO2)C1CNCCO1
InChIInChI=1S/C17H26N2O2/c1-19(2)8-5-15(17-12-18-7-10-21-17)13-3-4-16-14(11-13)6-9-20-16/h3-4,11,15,17-18H,5-10,12H2,1-2H3
InChIKeyYQSUXLUWSZYCPY-UHFFFAOYSA-N
XLogP1.65
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine with MolForge

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Related Compounds

3-(2,3-dihydro-1-benzofuran-5-yl)-N-methyl-3-morpholin-2-ylpropan-1-amine
CID 86678630
1-(2,3-dihydro-1-benzofuran-5-yl)-N,N',N'-trimethylpropane-1,3-diamine
CID 104542785
1-(2,3-dihydro-1-benzofuran-5-yl)-N-ethyl-N',N'-dimethylpropane-1,3-diamine
CID 113425129
2,3-dihydro-1-benzofuran-5-yl(piperidin-3-yl)methanol
CID 43146492
1-(2,3-dihydro-1-benzofuran-5-yl)-1-methoxy-N,N-dimethylmethanamine
CID 116914533
5-butan-2-yl-2,3-dihydro-1-benzofuran
CID 89176252
1-(2,3-dihydro-1-benzofuran-5-yl)butan-1-ol
CID 61100081
4-[2,3-dihydro-1-benzofuran-5-yl(fluoro)methyl]piperidine
CID 104545402
2,3-dihydro-1-benzofuran-5-yl(piperidin-4-yl)methanol
CID 43146493
1-[(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperazine
CID 96840191
3-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl-methylamino]propane-1-thiol
CID 115225274
1-(2,3-dihydro-1-benzofuran-5-yl)-N-methyl-1-(oxolan-2-yl)methanamine
CID 43482564

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine?
The IUPAC name of 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine (CID 86678629) is 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine.
What is the SMILES notation for 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine?
The canonical SMILES for 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine is CN(C)CCC(c1ccc2c(c1)CCO2)C1CNCCO1.
What is the InChIKey of 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine?
The InChIKey is YQSUXLUWSZYCPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-19(2)8-5-15(17-12-18-7-10-21-17)13-3-4-16-14(11-13)6-9-20-16/h3-4,11,15,17-18H,5-10,12H2,1-2H3.
What are the key properties of 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine?
3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine has a molecular weight of 290.41 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1-benzofuran-5-yl)-N,N-dimethyl-3-morpholin-2-ylpropan-1-amine is sourced from PubChem (CID 86678629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).