2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide

C17H15N3O2S — CID 52612392

IUPAC2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(Nc2ccccc2C(=O)Nc2nccs2)cc1
InChIInChI=1S/C17H15N3O2S/c1-22-13-8-6-12(7-9-13)19-15-5-3-2-4-14(15)16(21)20-17-18-10-11-23-17/h2-11,19H,1H3,(H,18,20,21)
InChIKeyYGQXKANQZTYCOW-UHFFFAOYSA-N
MW325.39 g/mol
LogP4.15
Rot. Bonds5

About 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide

2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 52612392) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide
PubChem CID52612392
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC Name2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(Nc2ccccc2C(=O)Nc2nccs2)cc1
InChIInChI=1S/C17H15N3O2S/c1-22-13-8-6-12(7-9-13)19-15-5-3-2-4-14(15)16(21)20-17-18-10-11-23-17/h2-11,19H,1H3,(H,18,20,21)
InChIKeyYGQXKANQZTYCOW-UHFFFAOYSA-N
XLogP4.15
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dimethoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 17361080
2-[(2-methoxybenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361063
N-(4-methoxyphenyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 45000900
2-(4-methoxyanilino)-N-(4-methyl-2-pyridinyl)benzamide
CID 52612517
2-(propan-2-ylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 63107522
2-[2-(2-methoxyanilino)-2-oxoethoxy]-N-(1,3-thiazol-2-yl)benzamide
CID 1301072
bis[2-(4-methoxyanilino)phenyl]methanone
CID 141301142
3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 17361254
2-[[2-(4-tert-butylphenoxy)acetyl]amino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361130
2-[2-(4-methylphenoxy)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361272
2-[2-(4-chlorophenoxy)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361278
2-chloro-N-[2-(4-methoxyanilino)phenyl]benzamide
CID 86081867

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide (CID 52612392) is 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide is COc1ccc(Nc2ccccc2C(=O)Nc2nccs2)cc1.
What is the InChIKey of 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is YGQXKANQZTYCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c1-22-13-8-6-12(7-9-13)19-15-5-3-2-4-14(15)16(21)20-17-18-10-11-23-17/h2-11,19H,1H3,(H,18,20,21).
What are the key properties of 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide?
2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 325.39 g/mol, XLogP of 4.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 52612392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).