N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide

C23H24N2O2S2 — CID 3202491

IUPACN-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide
SMILESO=C(NC1CCCC1)C(c1ccsc1)N(C(=O)Cc1cccs1)c1ccccc1
InChIInChI=1S/C23H24N2O2S2/c26-21(15-20-11-6-13-29-20)25(19-9-2-1-3-10-19)22(17-12-14-28-16-17)23(27)24-18-7-4-5-8-18/h1-3,6,9-14,16,18,22H,4-5,7-8,15H2,(H,24,27)
InChIKeyWYTJNTVBBHZTLC-UHFFFAOYSA-N
MW424.59 g/mol
LogP5.19
Rot. Bonds7

About N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide

N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide (PubChem CID 3202491) has the molecular formula C23H24N2O2S2 and a molecular weight of 424.59 g/mol. Its IUPAC name is N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide
PubChem CID3202491
Molecular FormulaC23H24N2O2S2
Molecular Weight424.59 g/mol
Exact Mass424.13
IUPAC NameN-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide
SMILESO=C(NC1CCCC1)C(c1ccsc1)N(C(=O)Cc1cccs1)c1ccccc1
InChIInChI=1S/C23H24N2O2S2/c26-21(15-20-11-6-13-29-20)25(19-9-2-1-3-10-19)22(17-12-14-28-16-17)23(27)24-18-7-4-5-8-18/h1-3,6,9-14,16,18,22H,4-5,7-8,15H2,(H,24,27)
InChIKeyWYTJNTVBBHZTLC-UHFFFAOYSA-N
XLogP5.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.59
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
The IUPAC name of N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide (CID 3202491) is N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide.
What is the SMILES notation for N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
The canonical SMILES for N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide is O=C(NC1CCCC1)C(c1ccsc1)N(C(=O)Cc1cccs1)c1ccccc1.
What is the InChIKey of N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
The InChIKey is WYTJNTVBBHZTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2S2/c26-21(15-20-11-6-13-29-20)25(19-9-2-1-3-10-19)22(17-12-14-28-16-17)23(27)24-18-7-4-5-8-18/h1-3,6,9-14,16,18,22H,4-5,7-8,15H2,(H,24,27).
What are the key properties of N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide?
N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide has a molecular weight of 424.59 g/mol, XLogP of 5.19, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-thiophen-3-yl-2-(N-(2-thiophen-2-ylacetyl)anilino)acetamide is sourced from PubChem (CID 3202491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).