[1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine

C10H8N2O2 — CID 83847087

IUPAC[1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine
SMILESNCc1onc2c1oc1ccccc12
InChIInChI=1S/C10H8N2O2/c11-5-8-10-9(12-14-8)6-3-1-2-4-7(6)13-10/h1-4H,5,11H2
InChIKeyOXIBKYQWNMRZCI-UHFFFAOYSA-N
MW188.19 g/mol
LogP2.03
Rot. Bonds1

About [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine

[1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine (PubChem CID 83847087) has the molecular formula C10H8N2O2 and a molecular weight of 188.19 g/mol. Its IUPAC name is [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine.

Molecular Properties

Compound Name[1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine
PubChem CID83847087
Molecular FormulaC10H8N2O2
Molecular Weight188.19 g/mol
Exact Mass188.06
IUPAC Name[1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine
SMILESNCc1onc2c1oc1ccccc12
InChIInChI=1S/C10H8N2O2/c11-5-8-10-9(12-14-8)6-3-1-2-4-7(6)13-10/h1-4H,5,11H2
InChIKeyOXIBKYQWNMRZCI-UHFFFAOYSA-N
XLogP2.03
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine?
The IUPAC name of [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine (CID 83847087) is [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine.
What is the SMILES notation for [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine?
The canonical SMILES for [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine is NCc1onc2c1oc1ccccc12.
What is the InChIKey of [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine?
The InChIKey is OXIBKYQWNMRZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2/c11-5-8-10-9(12-14-8)6-3-1-2-4-7(6)13-10/h1-4H,5,11H2.
What are the key properties of [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine?
[1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine has a molecular weight of 188.19 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1]benzofuro[3,2-c][1,2]oxazol-3-ylmethanamine is sourced from PubChem (CID 83847087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).