3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide

C17H14FN3OS — CID 167518263

IUPAC3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cc(F)cc(-c3cnccc3C)c2)n1
InChIInChI=1S/C17H14FN3OS/c1-10-3-4-19-8-15(10)12-5-13(7-14(18)6-12)16(22)21-17-20-11(2)9-23-17/h3-9H,1-2H3,(H,20,21,22)
InChIKeyOJQFWXRVBSPPSM-UHFFFAOYSA-N
MW327.38 g/mol
LogP4.21
Rot. Bonds3

About 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide

3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 167518263) has the molecular formula C17H14FN3OS and a molecular weight of 327.38 g/mol. Its IUPAC name is 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID167518263
Molecular FormulaC17H14FN3OS
Molecular Weight327.38 g/mol
Exact Mass327.08
IUPAC Name3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cc(F)cc(-c3cnccc3C)c2)n1
InChIInChI=1S/C17H14FN3OS/c1-10-3-4-19-8-15(10)12-5-13(7-14(18)6-12)16(22)21-17-20-11(2)9-23-17/h3-9H,1-2H3,(H,20,21,22)
InChIKeyOJQFWXRVBSPPSM-UHFFFAOYSA-N
XLogP4.21
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 172523643
7-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)-1,3-benzothiazole-5-carboxamide
CID 171092022
5-chloro-4-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 171091225
3,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 1246749
N-(4-methyl-1,3-thiazol-2-yl)-5-pyridin-3-yloxypyridine-3-carboxamide
CID 86762172
N-(4-methyl-1,3-thiazol-2-yl)-4-pyrimidin-5-ylbenzamide
CID 56857360
6-(3,5-difluorophenyl)-2-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyrimidine-4-carboxamide
CID 24820775
4-(5-fluoro-3-pyridinyl)-6-methyl-N-(4-methyl-1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 24820773
2-methoxy-N-[4-(4-methyl-3-pyridinyl)-1,3-thiazol-2-yl]pyrimidine-5-carboxamide
CID 162387055
4-bromo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 683754
4-N-(4-methyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 47106736
4-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 885062

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 167518263) is 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide is Cc1csc(NC(=O)c2cc(F)cc(-c3cnccc3C)c2)n1.
What is the InChIKey of 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is OJQFWXRVBSPPSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3OS/c1-10-3-4-19-8-15(10)12-5-13(7-14(18)6-12)16(22)21-17-20-11(2)9-23-17/h3-9H,1-2H3,(H,20,21,22).
What are the key properties of 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 327.38 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-(4-methyl-3-pyridinyl)-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 167518263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).