phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate

C22H18N2O4 — CID 126004369

IUPACphenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate
SMILESCN(CC(=O)Nc1ccc2c(c1)oc1ccccc12)C(=O)Oc1ccccc1
InChIInChI=1S/C22H18N2O4/c1-24(22(26)27-16-7-3-2-4-8-16)14-21(25)23-15-11-12-18-17-9-5-6-10-19(17)28-20(18)13-15/h2-13H,14H2,1H3,(H,23,25)
InChIKeyHOVCBIRMHQBSSF-UHFFFAOYSA-N
MW374.40 g/mol
LogP4.66
Rot. Bonds4

About phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate

phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate (PubChem CID 126004369) has the molecular formula C22H18N2O4 and a molecular weight of 374.40 g/mol. Its IUPAC name is phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate.

Molecular Properties

Compound Namephenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate
PubChem CID126004369
Molecular FormulaC22H18N2O4
Molecular Weight374.40 g/mol
Exact Mass374.13
IUPAC Namephenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate
SMILESCN(CC(=O)Nc1ccc2c(c1)oc1ccccc12)C(=O)Oc1ccccc1
InChIInChI=1S/C22H18N2O4/c1-24(22(26)27-16-7-3-2-4-8-16)14-21(25)23-15-11-12-18-17-9-5-6-10-19(17)28-20(18)13-15/h2-13H,14H2,1H3,(H,23,25)
InChIKeyHOVCBIRMHQBSSF-UHFFFAOYSA-N
XLogP4.66
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

phenyl N-[2-(4-bromoanilino)-2-oxoethyl]-N-methylcarbamate
CID 4714172
N-dibenzofuran-3-yl-2-phenoxypropanamide
CID 133234579
phenyl N-methyl-N-[2-oxo-2-(propylamino)ethyl]carbamate
CID 60636579
N-dibenzofuran-3-yl-2-(4-propan-2-ylphenoxy)acetamide
CID 3150701
[2-(dibenzofuran-3-ylamino)-2-oxoethyl] N,N-diethylcarbamodithioate
CID 2915941
N-dibenzofuran-2-yl-2-[(4-methoxyphenyl)methyl-methylamino]acetamide
CID 8557300
2-[N-(benzenesulfonyl)-3-methylanilino]-N-dibenzofuran-3-ylacetamide
CID 2916107
methyl N-[2-(3-methoxyanilino)-2-oxoethyl]-N-methylcarbamate
CID 47129052
N-dibenzofuran-3-yl-2,2-dimethylpropanamide
CID 15495610
3-[2-(dibenzofuran-3-ylcarbamoylamino)ethyl]-1,1-dimethylurea
CID 75475921
N-dibenzofuran-3-yl-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide
CID 55685179
N-(2-anilino-2-oxoethyl)-N-methyl-3-(phenoxymethyl)-1-benzofuran-2-carboxamide
CID 46808303

Frequently Asked Questions

What is the IUPAC name of phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate?
The IUPAC name of phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate (CID 126004369) is phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate.
What is the SMILES notation for phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate?
The canonical SMILES for phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate is CN(CC(=O)Nc1ccc2c(c1)oc1ccccc12)C(=O)Oc1ccccc1.
What is the InChIKey of phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate?
The InChIKey is HOVCBIRMHQBSSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O4/c1-24(22(26)27-16-7-3-2-4-8-16)14-21(25)23-15-11-12-18-17-9-5-6-10-19(17)28-20(18)13-15/h2-13H,14H2,1H3,(H,23,25).
What are the key properties of phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate?
phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate has a molecular weight of 374.40 g/mol, XLogP of 4.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-[2-(dibenzofuran-3-ylamino)-2-oxoethyl]-N-methylcarbamate is sourced from PubChem (CID 126004369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).