(3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine

C10H11NO — CID 130739093

IUPAC(3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine
SMILESC=Cc1cccc2c1OC[C@@H]2N
InChIInChI=1S/C10H11NO/c1-2-7-4-3-5-8-9(11)6-12-10(7)8/h2-5,9H,1,6,11H2/t9-/m0/s1
InChIKeyYRCRDVAMCBXEAQ-VIFPVBQESA-N
MW161.20 g/mol
LogP1.72
Rot. Bonds1

About (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine

(3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 130739093) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name(3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine
PubChem CID130739093
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine
SMILESC=Cc1cccc2c1OC[C@@H]2N
InChIInChI=1S/C10H11NO/c1-2-7-4-3-5-8-9(11)6-12-10(7)8/h2-5,9H,1,6,11H2/t9-/m0/s1
InChIKeyYRCRDVAMCBXEAQ-VIFPVBQESA-N
XLogP1.72
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine (CID 130739093) is (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine is C=Cc1cccc2c1OC[C@@H]2N.
What is the InChIKey of (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is YRCRDVAMCBXEAQ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H11NO/c1-2-7-4-3-5-8-9(11)6-12-10(7)8/h2-5,9H,1,6,11H2/t9-/m0/s1.
What are the key properties of (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine?
(3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 161.20 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-7-ethenyl-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 130739093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).