N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide

C19H19N3OS — CID 53432163

IUPACN-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(-c2cccc(C)c2)c(-c2cc(C)nc(C)c2)s1
InChIInChI=1S/C19H19N3OS/c1-11-6-5-7-15(8-11)17-18(24-19(22-17)21-14(4)23)16-9-12(2)20-13(3)10-16/h5-10H,1-4H3,(H,21,22,23)
InChIKeySGHWRTXAJNWBQQ-UHFFFAOYSA-N
MW337.45 g/mol
LogP4.76
Rot. Bonds3

About N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide

N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 53432163) has the molecular formula C19H19N3OS and a molecular weight of 337.45 g/mol. Its IUPAC name is N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide
PubChem CID53432163
Molecular FormulaC19H19N3OS
Molecular Weight337.45 g/mol
Exact Mass337.12
IUPAC NameN-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1nc(-c2cccc(C)c2)c(-c2cc(C)nc(C)c2)s1
InChIInChI=1S/C19H19N3OS/c1-11-6-5-7-15(8-11)17-18(24-19(22-17)21-14(4)23)16-9-12(2)20-13(3)10-16/h5-10H,1-4H3,(H,21,22,23)
InChIKeySGHWRTXAJNWBQQ-UHFFFAOYSA-N
XLogP4.76
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-amino-6-methyl-4-pyridinyl)-4-(3-methylphenyl)-N-prop-1-en-2-yl-1,3-thiazol-2-amine;methanamine;methane
CID 162688437
N-[4-(3,5-dimethylphenyl)-5-pyridin-3-yl-1,3-thiazol-2-yl]acetamide
CID 22993732
N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]pyrrolidine-1-carboxamide
CID 162688237
N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-1,1-dioxo-1,4-thiazine-4-carboxamide
CID 175453778
(3aS,6aR)-N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]pyrrole-5-carboxamide
CID 162688125
N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-1-imino-1-oxo-1,4-thiazine-4-carboxamide
CID 175453758
N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-3-hydroxypyrrolidine-1-carboxamide
CID 169060197
(2R,6R)-N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-2,6-dimethylpiperazine-1-carboxamide
CID 169002941
(3S)-N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-3,5-dimethylpiperazine-1-carboxamide
CID 166959531
N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-4-sulfamoylpiperazine-1-carboxamide
CID 162688189
(1S,4S)-N-[4-(3-cyanophenyl)-5-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-2-yl]-5-methyl-2,5-diazabicyclo[2.2.1]heptane-2-carboxamide
CID 162688343
N-ethyl-4-(3-methylphenyl)-5-pyridin-4-yl-1,3-thiazol-2-amine
CID 53437684

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide (CID 53432163) is N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1nc(-c2cccc(C)c2)c(-c2cc(C)nc(C)c2)s1.
What is the InChIKey of N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is SGHWRTXAJNWBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3OS/c1-11-6-5-7-15(8-11)17-18(24-19(22-17)21-14(4)23)16-9-12(2)20-13(3)10-16/h5-10H,1-4H3,(H,21,22,23).
What are the key properties of N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide?
N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 337.45 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,6-dimethyl-4-pyridinyl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 53432163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).