5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine

C10H13NO3 — CID 55269219

IUPAC5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCOc1cc2c(cc1OC)C(N)CO2
InChIInChI=1S/C10H13NO3/c1-12-9-3-6-7(11)5-14-8(6)4-10(9)13-2/h3-4,7H,5,11H2,1-2H3
InChIKeyPGNMLXHRNIPQAB-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.10
Rot. Bonds2

About 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine

5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 55269219) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine
PubChem CID55269219
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCOc1cc2c(cc1OC)C(N)CO2
InChIInChI=1S/C10H13NO3/c1-12-9-3-6-7(11)5-14-8(6)4-10(9)13-2/h3-4,7H,5,11H2,1-2H3
InChIKeyPGNMLXHRNIPQAB-UHFFFAOYSA-N
XLogP1.10
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-2,3-dihydro-1-benzofuran-3,5-diamine
CID 55294789
3-amino-5-methoxy-2,3-dihydro-1-benzofuran-6-ol
CID 55292013
3-amino-6,7-dimethoxy-2,3-dihydrochromen-4-one
CID 91622426
(3S)-5-ethoxy-6-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 130676187
ethyl 2-(5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-yl)acetate
CID 170367856
2,3-dihydrobenzo[f][1]benzofuran-3-amine
CID 55272031
(4S)-7-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine
CID 130658442
6-[(2-methoxy-5-methylphenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine
CID 63096723
6-[(5-bromo-2-methoxyphenyl)methoxy]-2,3-dihydro-1-benzofuran-3-amine
CID 63096189
(3S)-5-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine
CID 131146644
(1R,12R)-15,16-dimethoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaene
CID 44584106
4-methoxy-2,3-dihydro-1-benzofuran-3-amine;hydrochloride
CID 119057116

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine (CID 55269219) is 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine is COc1cc2c(cc1OC)C(N)CO2.
What is the InChIKey of 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is PGNMLXHRNIPQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-12-9-3-6-7(11)5-14-8(6)4-10(9)13-2/h3-4,7H,5,11H2,1-2H3.
What are the key properties of 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine?
5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 195.22 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 55269219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).