(3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone

C14H15NO3 — CID 768761

IUPAC(3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone
SMILESCc1c(C(=O)N2CCOCC2)oc2ccccc12
InChIInChI=1S/C14H15NO3/c1-10-11-4-2-3-5-12(11)18-13(10)14(16)15-6-8-17-9-7-15/h2-5H,6-9H2,1H3
InChIKeyRAZPIHGOBANJIH-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.21
Rot. Bonds1

About (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone

(3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone (PubChem CID 768761) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone
PubChem CID768761
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name(3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone
SMILESCc1c(C(=O)N2CCOCC2)oc2ccccc12
InChIInChI=1S/C14H15NO3/c1-10-11-4-2-3-5-12(11)18-13(10)14(16)15-6-8-17-9-7-15/h2-5H,6-9H2,1H3
InChIKeyRAZPIHGOBANJIH-UHFFFAOYSA-N
XLogP2.21
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
The IUPAC name of (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone (CID 768761) is (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone is Cc1c(C(=O)N2CCOCC2)oc2ccccc12.
What is the InChIKey of (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
The InChIKey is RAZPIHGOBANJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-10-11-4-2-3-5-12(11)18-13(10)14(16)15-6-8-17-9-7-15/h2-5H,6-9H2,1H3.
What are the key properties of (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone?
(3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone has a molecular weight of 245.28 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-1-benzofuran-2-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 768761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).