2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine

C17H19NO3 — CID 43197229

IUPAC2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine
SMILESCOc1ccc(OC)c(C(N)C2Cc3ccccc3O2)c1
InChIInChI=1S/C17H19NO3/c1-19-12-7-8-15(20-2)13(10-12)17(18)16-9-11-5-3-4-6-14(11)21-16/h3-8,10,16-17H,9,18H2,1-2H3
InChIKeyFZWJEQZEFRMORG-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.71
Rot. Bonds4

About 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine

2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine (PubChem CID 43197229) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine
PubChem CID43197229
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine
SMILESCOc1ccc(OC)c(C(N)C2Cc3ccccc3O2)c1
InChIInChI=1S/C17H19NO3/c1-19-12-7-8-15(20-2)13(10-12)17(18)16-9-11-5-3-4-6-14(11)21-16/h3-8,10,16-17H,9,18H2,1-2H3
InChIKeyFZWJEQZEFRMORG-UHFFFAOYSA-N
XLogP2.71
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-bromo-4-methoxyphenyl)-chloromethyl]-2,3-dihydro-1-benzofuran
CID 63435447
[2,3-dihydro-1-benzofuran-2-yl-(2-methoxy-5-methylphenyl)methyl]hydrazine
CID 105262926
2,3-dihydro-1,4-benzodioxin-3-yl-(2-methoxy-5-methylphenyl)methanamine
CID 43626167
(S)-(2,5-dimethoxyphenyl)-(oxan-4-yl)methanamine
CID 94891789
2-[chloro-(2,5-dimethoxyphenyl)methyl]-2,3-dihydro-1H-indene
CID 106893752
(R)-cyclohexyl-(2,5-dimethoxyphenyl)methanamine;hydrochloride
CID 171200242
N-[1-(2,5-dimethoxyphenyl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 119164773
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,5-dimethoxyphenyl)methanamine
CID 105009947
1-(2,3-dihydro-1-benzofuran-2-yl)-2-(2-fluoro-3-methoxyphenyl)ethanamine
CID 104794253
2-[bromo-(4-methoxy-3-methylphenyl)methyl]-2,3-dihydro-1-benzofuran
CID 63442838
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanamine
CID 43197194
(2,5-dimethoxyphenyl)-(4-methoxyphenyl)methanamine
CID 43197203

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine?
The IUPAC name of 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine (CID 43197229) is 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine?
The canonical SMILES for 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine is COc1ccc(OC)c(C(N)C2Cc3ccccc3O2)c1.
What is the InChIKey of 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine?
The InChIKey is FZWJEQZEFRMORG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-19-12-7-8-15(20-2)13(10-12)17(18)16-9-11-5-3-4-6-14(11)21-16/h3-8,10,16-17H,9,18H2,1-2H3.
What are the key properties of 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine?
2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine has a molecular weight of 285.34 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-2-yl-(2,5-dimethoxyphenyl)methanamine is sourced from PubChem (CID 43197229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).