N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide

C23H24N2O4S — CID 4989880

IUPACN,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide
SMILESCOc1ccc(NC(=O)C(c2ccc(OC)cc2)N(C)C(=O)Cc2cccs2)cc1
InChIInChI=1S/C23H24N2O4S/c1-25(21(26)15-20-5-4-14-30-20)22(16-6-10-18(28-2)11-7-16)23(27)24-17-8-12-19(29-3)13-9-17/h4-14,22H,15H2,1-3H3,(H,24,27)
InChIKeyKASCLAHCVGWNBO-UHFFFAOYSA-N
MW424.52 g/mol
LogP4.15
Rot. Bonds8

About N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide

N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide (PubChem CID 4989880) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide.

Molecular Properties

Compound NameN,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide
PubChem CID4989880
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC NameN,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide
SMILESCOc1ccc(NC(=O)C(c2ccc(OC)cc2)N(C)C(=O)Cc2cccs2)cc1
InChIInChI=1S/C23H24N2O4S/c1-25(21(26)15-20-5-4-14-30-20)22(16-6-10-18(28-2)11-7-16)23(27)24-17-8-12-19(29-3)13-9-17/h4-14,22H,15H2,1-3H3,(H,24,27)
InChIKeyKASCLAHCVGWNBO-UHFFFAOYSA-N
XLogP4.15
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide?
The IUPAC name of N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide (CID 4989880) is N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide.
What is the SMILES notation for N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide?
The canonical SMILES for N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide is COc1ccc(NC(=O)C(c2ccc(OC)cc2)N(C)C(=O)Cc2cccs2)cc1.
What is the InChIKey of N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide?
The InChIKey is KASCLAHCVGWNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-25(21(26)15-20-5-4-14-30-20)22(16-6-10-18(28-2)11-7-16)23(27)24-17-8-12-19(29-3)13-9-17/h4-14,22H,15H2,1-3H3,(H,24,27).
What are the key properties of N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide?
N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide has a molecular weight of 424.52 g/mol, XLogP of 4.15, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-bis(4-methoxyphenyl)-2-[methyl-(2-thiophen-2-ylacetyl)amino]acetamide is sourced from PubChem (CID 4989880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).