N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide

C20H16N2O3S — CID 2357033

IUPACN-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide
SMILESCOc1cc2c(cc1NC(=O)CSc1ccccn1)oc1ccccc12
InChIInChI=1S/C20H16N2O3S/c1-24-18-10-14-13-6-2-3-7-16(13)25-17(14)11-15(18)22-19(23)12-26-20-8-4-5-9-21-20/h2-11H,12H2,1H3,(H,22,23)
InChIKeyIGFOFLGQRBUWRF-UHFFFAOYSA-N
MW364.43 g/mol
LogP4.72
Rot. Bonds5

About N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide

N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide (PubChem CID 2357033) has the molecular formula C20H16N2O3S and a molecular weight of 364.43 g/mol. Its IUPAC name is N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide
PubChem CID2357033
Molecular FormulaC20H16N2O3S
Molecular Weight364.43 g/mol
Exact Mass364.09
IUPAC NameN-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide
SMILESCOc1cc2c(cc1NC(=O)CSc1ccccn1)oc1ccccc12
InChIInChI=1S/C20H16N2O3S/c1-24-18-10-14-13-6-2-3-7-16(13)25-17(14)11-15(18)22-19(23)12-26-20-8-4-5-9-21-20/h2-11H,12H2,1H3,(H,22,23)
InChIKeyIGFOFLGQRBUWRF-UHFFFAOYSA-N
XLogP4.72
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.43
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-dibenzofuran-3-yl-2-pyridin-2-ylsulfanylacetamide
CID 592486
(E)-2-[4-(4-Fluoro-phenyl)-thiazol-2-yl]-3-(2-methoxy-dibenzofuran-3-ylamino)-acrylonitrile
CID 5929621
N-(2-methoxydibenzofuran-3-yl)-2-pyridin-4-ylquinoline-4-carboxamide
CID 2098333
N-(2-methoxydibenzofuran-3-yl)-6-methyl-2-pyridin-3-ylquinoline-4-carboxamide
CID 2220529
N-(2-methoxydibenzofuran-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide
CID 2413704
5-bromo-N-(2-methoxydibenzo[b,d]furan-3-yl)nicotinamide
CID 2634087
N-(2-methoxydibenzo[b,d]furan-3-yl)isonicotinamide
CID 2684593
N-(2-methoxydibenzofuran-3-yl)-2-phenylsulfanylacetamide
CID 2944641
N-(2-methoxydibenzofuran-3-yl)-6-methyl-2-pyridin-4-ylquinoline-4-carboxamide
CID 2965581
N-(2-methoxydibenzofuran-3-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide
CID 3563848
Methyl 3-[(2-pyridin-2-ylsulfanylacetyl)amino]-1-benzofuran-2-carboxylate
CID 52941881
Methyl 3-(3-pyridin-2-ylsulfanylpropanoylamino)-1-benzofuran-2-carboxylate
CID 52946717

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide?
The IUPAC name of N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide (CID 2357033) is N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide.
What is the SMILES notation for N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide?
The canonical SMILES for N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide is COc1cc2c(cc1NC(=O)CSc1ccccn1)oc1ccccc12.
What is the InChIKey of N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide?
The InChIKey is IGFOFLGQRBUWRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3S/c1-24-18-10-14-13-6-2-3-7-16(13)25-17(14)11-15(18)22-19(23)12-26-20-8-4-5-9-21-20/h2-11H,12H2,1H3,(H,22,23).
What are the key properties of N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide?
N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide has a molecular weight of 364.43 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxydibenzofuran-3-yl)-2-pyridin-2-ylsulfanylacetamide is sourced from PubChem (CID 2357033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).