4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine

C14H19NO2 — CID 3041918

IUPAC4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine
SMILESCC1(C)Oc2ccccc2C1N1CCOCC1
InChIInChI=1S/C14H19NO2/c1-14(2)13(15-7-9-16-10-8-15)11-5-3-4-6-12(11)17-14/h3-6,13H,7-10H2,1-2H3
InChIKeyRAXKVCFRGHVUGD-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.23
Rot. Bonds1

About 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine

4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine (PubChem CID 3041918) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine.

Molecular Properties

Compound Name4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine
PubChem CID3041918
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine
SMILESCC1(C)Oc2ccccc2C1N1CCOCC1
InChIInChI=1S/C14H19NO2/c1-14(2)13(15-7-9-16-10-8-15)11-5-3-4-6-12(11)17-14/h3-6,13H,7-10H2,1-2H3
InChIKeyRAXKVCFRGHVUGD-UHFFFAOYSA-N
XLogP2.23
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine?
The IUPAC name of 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine (CID 3041918) is 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine.
What is the SMILES notation for 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine?
The canonical SMILES for 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine is CC1(C)Oc2ccccc2C1N1CCOCC1.
What is the InChIKey of 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine?
The InChIKey is RAXKVCFRGHVUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-14(2)13(15-7-9-16-10-8-15)11-5-3-4-6-12(11)17-14/h3-6,13H,7-10H2,1-2H3.
What are the key properties of 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine?
4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine has a molecular weight of 233.31 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethyl-3H-1-benzofuran-3-yl)morpholine is sourced from PubChem (CID 3041918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).