N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide

C25H22N2O3S — CID 3216732

IUPACN-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide
SMILESO=C(NCc1ccco1)C(c1ccccc1)N(C(=O)Cc1cccs1)c1ccccc1
InChIInChI=1S/C25H22N2O3S/c28-23(17-22-14-8-16-31-22)27(20-11-5-2-6-12-20)24(19-9-3-1-4-10-19)25(29)26-18-21-13-7-15-30-21/h1-16,24H,17-18H2,(H,26,29)
InChIKeyRAWAEJBUHYVAIP-UHFFFAOYSA-N
MW430.53 g/mol
LogP4.97
Rot. Bonds8

About N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide

N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide (PubChem CID 3216732) has the molecular formula C25H22N2O3S and a molecular weight of 430.53 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide
PubChem CID3216732
Molecular FormulaC25H22N2O3S
Molecular Weight430.53 g/mol
Exact Mass430.14
IUPAC NameN-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide
SMILESO=C(NCc1ccco1)C(c1ccccc1)N(C(=O)Cc1cccs1)c1ccccc1
InChIInChI=1S/C25H22N2O3S/c28-23(17-22-14-8-16-31-22)27(20-11-5-2-6-12-20)24(19-9-3-1-4-10-19)25(29)26-18-21-13-7-15-30-21/h1-16,24H,17-18H2,(H,26,29)
InChIKeyRAWAEJBUHYVAIP-UHFFFAOYSA-N
XLogP4.97
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.53
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide (CID 3216732) is N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide is O=C(NCc1ccco1)C(c1ccccc1)N(C(=O)Cc1cccs1)c1ccccc1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
The InChIKey is RAWAEJBUHYVAIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O3S/c28-23(17-22-14-8-16-31-22)27(20-11-5-2-6-12-20)24(19-9-3-1-4-10-19)25(29)26-18-21-13-7-15-30-21/h1-16,24H,17-18H2,(H,26,29).
What are the key properties of N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide has a molecular weight of 430.53 g/mol, XLogP of 4.97, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-phenyl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide is sourced from PubChem (CID 3216732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).