2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide

C20H21N3OS — CID 113032823

IUPAC2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide
SMILESCc1cc(C)c(Nc2ccc(NC(=O)Cc3cccs3)nc2)c(C)c1
InChIInChI=1S/C20H21N3OS/c1-13-9-14(2)20(15(3)10-13)22-16-6-7-18(21-12-16)23-19(24)11-17-5-4-8-25-17/h4-10,12,22H,11H2,1-3H3,(H,21,23,24)
InChIKeyNNFCNVUYNYLDNY-UHFFFAOYSA-N
MW351.48 g/mol
LogP4.99
Rot. Bonds5

About 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide

2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide (PubChem CID 113032823) has the molecular formula C20H21N3OS and a molecular weight of 351.48 g/mol. Its IUPAC name is 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide
PubChem CID113032823
Molecular FormulaC20H21N3OS
Molecular Weight351.48 g/mol
Exact Mass351.14
IUPAC Name2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide
SMILESCc1cc(C)c(Nc2ccc(NC(=O)Cc3cccs3)nc2)c(C)c1
InChIInChI=1S/C20H21N3OS/c1-13-9-14(2)20(15(3)10-13)22-16-6-7-18(21-12-16)23-19(24)11-17-5-4-8-25-17/h4-10,12,22H,11H2,1-3H3,(H,21,23,24)
InChIKeyNNFCNVUYNYLDNY-UHFFFAOYSA-N
XLogP4.99
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.48
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[5-(3-chloro-4-methylanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113033626
N-[5-(3,5-dichloroanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113036797
N-[6-(methylamino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 115268484
N-[5-(1,3-benzodioxol-5-ylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113036157
methyl 2-[[6-[(2-thiophen-2-ylacetyl)amino]-3-pyridinyl]amino]benzoate
CID 113035267
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113034634
N-[6-(4-fluoroanilino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113018323
N-[6-(3-acetylanilino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113020325
N-[6-(cyclohexylamino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113010070
N-[5-(2-morpholin-4-ylanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113035749
N-[5-(furan-2-ylmethylamino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113026265
N-[6-(pentylamino)-3-pyridinyl]-2-thiophen-2-ylacetamide
CID 113015222

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide?
The IUPAC name of 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide (CID 113032823) is 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide?
The canonical SMILES for 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide is Cc1cc(C)c(Nc2ccc(NC(=O)Cc3cccs3)nc2)c(C)c1.
What is the InChIKey of 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide?
The InChIKey is NNFCNVUYNYLDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3OS/c1-13-9-14(2)20(15(3)10-13)22-16-6-7-18(21-12-16)23-19(24)11-17-5-4-8-25-17/h4-10,12,22H,11H2,1-3H3,(H,21,23,24).
What are the key properties of 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide?
2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide has a molecular weight of 351.48 g/mol, XLogP of 4.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-yl-N-[5-(2,4,6-trimethylanilino)-2-pyridinyl]acetamide is sourced from PubChem (CID 113032823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).