2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide

C24H20FN5O4S — CID 137408491

IUPAC2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide
SMILESCc1sc(NC(=O)Cc2ccc(Oc3ncccc3C(N)=O)c(F)c2)nc1-c1ccc(=O)n(C)c1
InChIInChI=1S/C24H20FN5O4S/c1-13-21(15-6-8-20(32)30(2)12-15)29-24(35-13)28-19(31)11-14-5-7-18(17(25)10-14)34-23-16(22(26)33)4-3-9-27-23/h3-10,12H,11H2,1-2H3,(H2,26,33)(H,28,29,31)
InChIKeyARNLPRYEFTZDOQ-UHFFFAOYSA-N
MW493.52 g/mol
LogP3.42
Rot. Bonds7

About 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide

2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide (PubChem CID 137408491) has the molecular formula C24H20FN5O4S and a molecular weight of 493.52 g/mol. Its IUPAC name is 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide
PubChem CID137408491
Molecular FormulaC24H20FN5O4S
Molecular Weight493.52 g/mol
Exact Mass493.12
IUPAC Name2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide
SMILESCc1sc(NC(=O)Cc2ccc(Oc3ncccc3C(N)=O)c(F)c2)nc1-c1ccc(=O)n(C)c1
InChIInChI=1S/C24H20FN5O4S/c1-13-21(15-6-8-20(32)30(2)12-15)29-24(35-13)28-19(31)11-14-5-7-18(17(25)10-14)34-23-16(22(26)33)4-3-9-27-23/h3-10,12H,11H2,1-2H3,(H2,26,33)(H,28,29,31)
InChIKeyARNLPRYEFTZDOQ-UHFFFAOYSA-N
XLogP3.42
TPSA129.20 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500493.52
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide 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 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide?
The IUPAC name of 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide (CID 137408491) is 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide.
What is the SMILES notation for 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide?
The canonical SMILES for 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide is Cc1sc(NC(=O)Cc2ccc(Oc3ncccc3C(N)=O)c(F)c2)nc1-c1ccc(=O)n(C)c1.
What is the InChIKey of 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide?
The InChIKey is ARNLPRYEFTZDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN5O4S/c1-13-21(15-6-8-20(32)30(2)12-15)29-24(35-13)28-19(31)11-14-5-7-18(17(25)10-14)34-23-16(22(26)33)4-3-9-27-23/h3-10,12H,11H2,1-2H3,(H2,26,33)(H,28,29,31).
What are the key properties of 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide?
2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide has a molecular weight of 493.52 g/mol, XLogP of 3.42, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-fluoro-4-[2-[[5-methyl-4-(1-methyl-6-oxo-3-pyridinyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]phenoxy]pyridine-3-carboxamide is sourced from PubChem (CID 137408491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).