N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide

C17H17N3O3S — CID 7150930

IUPACN-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide
SMILESCOc1ccccc1-n1ccnc1SCC(=O)NCc1ccco1
InChIInChI=1S/C17H17N3O3S/c1-22-15-7-3-2-6-14(15)20-9-8-18-17(20)24-12-16(21)19-11-13-5-4-10-23-13/h2-10H,11-12H2,1H3,(H,19,21)
InChIKeyPFVFOLITEZOQNZ-UHFFFAOYSA-N
MW343.41 g/mol
LogP2.88
Rot. Bonds7

About N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide

N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide (PubChem CID 7150930) has the molecular formula C17H17N3O3S and a molecular weight of 343.41 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide
PubChem CID7150930
Molecular FormulaC17H17N3O3S
Molecular Weight343.41 g/mol
Exact Mass343.10
IUPAC NameN-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide
SMILESCOc1ccccc1-n1ccnc1SCC(=O)NCc1ccco1
InChIInChI=1S/C17H17N3O3S/c1-22-15-7-3-2-6-14(15)20-9-8-18-17(20)24-12-16(21)19-11-13-5-4-10-23-13/h2-10H,11-12H2,1H3,(H,19,21)
InChIKeyPFVFOLITEZOQNZ-UHFFFAOYSA-N
XLogP2.88
TPSA69.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide (CID 7150930) is N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide is COc1ccccc1-n1ccnc1SCC(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide?
The InChIKey is PFVFOLITEZOQNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3S/c1-22-15-7-3-2-6-14(15)20-9-8-18-17(20)24-12-16(21)19-11-13-5-4-10-23-13/h2-10H,11-12H2,1H3,(H,19,21).
What are the key properties of N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide?
N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide has a molecular weight of 343.41 g/mol, XLogP of 2.88, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[1-(2-methoxyphenyl)imidazol-2-yl]sulfanylacetamide is sourced from PubChem (CID 7150930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).