5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide

C23H23N5O2S — CID 70977807

IUPAC5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide
SMILESCCc1cncc(C(=O)Nc2ccc(-c3nc(-c4cc(C)on4)sc3CC)cn2)c1C
InChIInChI=1S/C23H23N5O2S/c1-5-15-10-24-12-17(14(15)4)22(29)26-20-8-7-16(11-25-20)21-19(6-2)31-23(27-21)18-9-13(3)30-28-18/h7-12H,5-6H2,1-4H3,(H,25,26,29)
InChIKeySAZOOACEHSAKGV-UHFFFAOYSA-N
MW433.54 g/mol
LogP5.25
Rot. Bonds6

About 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide

5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide (PubChem CID 70977807) has the molecular formula C23H23N5O2S and a molecular weight of 433.54 g/mol. Its IUPAC name is 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide
PubChem CID70977807
Molecular FormulaC23H23N5O2S
Molecular Weight433.54 g/mol
Exact Mass433.16
IUPAC Name5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide
SMILESCCc1cncc(C(=O)Nc2ccc(-c3nc(-c4cc(C)on4)sc3CC)cn2)c1C
InChIInChI=1S/C23H23N5O2S/c1-5-15-10-24-12-17(14(15)4)22(29)26-20-8-7-16(11-25-20)21-19(6-2)31-23(27-21)18-9-13(3)30-28-18/h7-12H,5-6H2,1-4H3,(H,25,26,29)
InChIKeySAZOOACEHSAKGV-UHFFFAOYSA-N
XLogP5.25
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.54
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-(5-methyl-2-pyridinyl)-4-(3-phenyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine
CID 51002828
4-(3-phenyl-1,2-oxazol-5-yl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 51002927
1-[5-[5-(3,5-Dimethyl-1,2-oxazol-4-yl)-3-pyridinyl]-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-2-pyridinyl]-3-ethylurea
CID 68639684
(2S)-2-[3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,6-dioxo-4,5-dihydropurin-7-yl]-N-[2-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]-1,3-thiazol-4-yl]propanamide
CID 139269402
2-[3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,6-dioxo-4,5-dihydropurin-7-yl]-N-[2-[6-methyl-5-(trifluoromethyl)-3-pyridinyl]-1,3-thiazol-4-yl]acetamide
CID 139269515
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-4-(4-methyl-1,3-thiazol-2-yl)-5-thiophen-3-ylpyrimidin-2-amine
CID 44522306
5-(3-methyl-1,2-oxazol-5-yl)-4-(5-methylthiophen-2-yl)-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 95799418
5-[2-(4-methylanilino)thiazol-4-yl]-N-(2-pyridyl)isoxazole-3-carboxamide
CID 134816824
N-[4-[4-(4-fluorophenyl)-2-piperidin-4-yl-1,3-thiazol-5-yl]pyrimidin-2-yl]-3-methyl-1,2-oxazol-5-amine
CID 155563141
5-methyl-N-(4-(pyridin-2-yl)thiazol-2-yl)isoxazole-3-carboxamide
CID 2462544
N-(4-methyl-2-pyridinyl)-4-(3-phenyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine
CID 51002928
N-(5-(5-ethyl-2-(3-methylisoxazol-5-yl)thiazol-4-yl)pyridin-2-yl)-5-fluoro-4-methylnicotinamide
CID 70978057

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide?
The IUPAC name of 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide (CID 70977807) is 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide?
The canonical SMILES for 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide is CCc1cncc(C(=O)Nc2ccc(-c3nc(-c4cc(C)on4)sc3CC)cn2)c1C.
What is the InChIKey of 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide?
The InChIKey is SAZOOACEHSAKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2S/c1-5-15-10-24-12-17(14(15)4)22(29)26-20-8-7-16(11-25-20)21-19(6-2)31-23(27-21)18-9-13(3)30-28-18/h7-12H,5-6H2,1-4H3,(H,25,26,29).
What are the key properties of 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide?
5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide has a molecular weight of 433.54 g/mol, XLogP of 5.25, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[5-[5-ethyl-2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]-2-pyridinyl]-4-methylpyridine-3-carboxamide is sourced from PubChem (CID 70977807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).