N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide

C22H18N2O4 — CID 2960943

IUPACN-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide
SMILESCNC(=O)COc1ccccc1C(=O)Nc1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C22H18N2O4/c1-23-21(25)13-27-18-8-4-3-7-17(18)22(26)24-14-10-11-16-15-6-2-5-9-19(15)28-20(16)12-14/h2-12H,13H2,1H3,(H,23,25)(H,24,26)
InChIKeyIQPWOVJACDCMBH-UHFFFAOYSA-N
MW374.40 g/mol
LogP3.96
Rot. Bonds5

About N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide

N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide (PubChem CID 2960943) has the molecular formula C22H18N2O4 and a molecular weight of 374.40 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide
PubChem CID2960943
Molecular FormulaC22H18N2O4
Molecular Weight374.40 g/mol
Exact Mass374.13
IUPAC NameN-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide
SMILESCNC(=O)COc1ccccc1C(=O)Nc1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C22H18N2O4/c1-23-21(25)13-27-18-8-4-3-7-17(18)22(26)24-14-10-11-16-15-6-2-5-9-19(15)28-20(16)12-14/h2-12H,13H2,1H3,(H,23,25)(H,24,26)
InChIKeyIQPWOVJACDCMBH-UHFFFAOYSA-N
XLogP3.96
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide?
The IUPAC name of N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide (CID 2960943) is N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide.
What is the SMILES notation for N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide?
The canonical SMILES for N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide is CNC(=O)COc1ccccc1C(=O)Nc1ccc2c(c1)oc1ccccc12.
What is the InChIKey of N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide?
The InChIKey is IQPWOVJACDCMBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O4/c1-23-21(25)13-27-18-8-4-3-7-17(18)22(26)24-14-10-11-16-15-6-2-5-9-19(15)28-20(16)12-14/h2-12H,13H2,1H3,(H,23,25)(H,24,26).
What are the key properties of N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide?
N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide has a molecular weight of 374.40 g/mol, XLogP of 3.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-2-[2-(methylamino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 2960943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).