N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide

C24H24FN3O2S — CID 3202587

IUPACN-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide
SMILESO=C(NC1CCCC1)C(c1ccncc1)N(C(=O)Cc1cccs1)c1cccc(F)c1
InChIInChI=1S/C24H24FN3O2S/c25-18-5-3-8-20(15-18)28(22(29)16-21-9-4-14-31-21)23(17-10-12-26-13-11-17)24(30)27-19-6-1-2-7-19/h3-5,8-15,19,23H,1-2,6-7,16H2,(H,27,30)
InChIKeyQFOOWPYEOUTSQM-UHFFFAOYSA-N
MW437.54 g/mol
LogP4.66
Rot. Bonds7

About N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide

N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide (PubChem CID 3202587) has the molecular formula C24H24FN3O2S and a molecular weight of 437.54 g/mol. Its IUPAC name is N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide
PubChem CID3202587
Molecular FormulaC24H24FN3O2S
Molecular Weight437.54 g/mol
Exact Mass437.16
IUPAC NameN-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide
SMILESO=C(NC1CCCC1)C(c1ccncc1)N(C(=O)Cc1cccs1)c1cccc(F)c1
InChIInChI=1S/C24H24FN3O2S/c25-18-5-3-8-20(15-18)28(22(29)16-21-9-4-14-31-21)23(17-10-12-26-13-11-17)24(30)27-19-6-1-2-7-19/h3-5,8-15,19,23H,1-2,6-7,16H2,(H,27,30)
InChIKeyQFOOWPYEOUTSQM-UHFFFAOYSA-N
XLogP4.66
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.54
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide 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-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide?
The IUPAC name of N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide (CID 3202587) is N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide?
The canonical SMILES for N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide is O=C(NC1CCCC1)C(c1ccncc1)N(C(=O)Cc1cccs1)c1cccc(F)c1.
What is the InChIKey of N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide?
The InChIKey is QFOOWPYEOUTSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN3O2S/c25-18-5-3-8-20(15-18)28(22(29)16-21-9-4-14-31-21)23(17-10-12-26-13-11-17)24(30)27-19-6-1-2-7-19/h3-5,8-15,19,23H,1-2,6-7,16H2,(H,27,30).
What are the key properties of N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide?
N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide has a molecular weight of 437.54 g/mol, XLogP of 4.66, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide is sourced from PubChem (CID 3202587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).