N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide

C22H24N2O2 — CID 21221684

IUPACN-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide
SMILESCN(C)C1CCc2oc3ccc(NC(=O)Cc4ccccc4)cc3c2C1
InChIInChI=1S/C22H24N2O2/c1-24(2)17-9-11-21-19(14-17)18-13-16(8-10-20(18)26-21)23-22(25)12-15-6-4-3-5-7-15/h3-8,10,13,17H,9,11-12,14H2,1-2H3,(H,23,25)
InChIKeyCKOIBMVGAKTKFL-UHFFFAOYSA-N
MW348.45 g/mol
LogP4.03
Rot. Bonds4

About N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide

N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide (PubChem CID 21221684) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide
PubChem CID21221684
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide
SMILESCN(C)C1CCc2oc3ccc(NC(=O)Cc4ccccc4)cc3c2C1
InChIInChI=1S/C22H24N2O2/c1-24(2)17-9-11-21-19(14-17)18-13-16(8-10-20(18)26-21)23-22(25)12-15-6-4-3-5-7-15/h3-8,10,13,17H,9,11-12,14H2,1-2H3,(H,23,25)
InChIKeyCKOIBMVGAKTKFL-UHFFFAOYSA-N
XLogP4.03
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide?
The IUPAC name of N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide (CID 21221684) is N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide.
What is the SMILES notation for N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide?
The canonical SMILES for N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide is CN(C)C1CCc2oc3ccc(NC(=O)Cc4ccccc4)cc3c2C1.
What is the InChIKey of N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide?
The InChIKey is CKOIBMVGAKTKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-24(2)17-9-11-21-19(14-17)18-13-16(8-10-20(18)26-21)23-22(25)12-15-6-4-3-5-7-15/h3-8,10,13,17H,9,11-12,14H2,1-2H3,(H,23,25).
What are the key properties of N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide?
N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide has a molecular weight of 348.45 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide is sourced from PubChem (CID 21221684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).