3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide

C14H15N3O3S — CID 110764330

IUPAC3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)cs2)cc1NC(C)=O
InChIInChI=1S/C14H15N3O3S/c1-8-7-21-14(15-8)17-13(19)10-4-5-12(20-3)11(6-10)16-9(2)18/h4-7H,1-3H3,(H,16,18)(H,15,17,19)
InChIKeyVWAJTAAXBIBXEC-UHFFFAOYSA-N
MW305.36 g/mol
LogP2.67
Rot. Bonds4

About 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide

3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 110764330) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID110764330
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2nc(C)cs2)cc1NC(C)=O
InChIInChI=1S/C14H15N3O3S/c1-8-7-21-14(15-8)17-13(19)10-4-5-12(20-3)11(6-10)16-9(2)18/h4-7H,1-3H3,(H,16,18)(H,15,17,19)
InChIKeyVWAJTAAXBIBXEC-UHFFFAOYSA-N
XLogP2.67
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17361583
3-methoxy-4-methyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17425685
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 46674292
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-phenylmethoxybenzamide
CID 2463682
5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 2679160
4-iodo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 885062
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
3,5-dimethyl-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 1246749
3-methoxy-N-(4-methyl-1,3-thiazol-2-yl)naphthalene-2-carboxamide
CID 2551174
4-cyano-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 2566426
N-(3-acetamido-4-methoxyphenyl)-2,3-dimethylquinoxaline-6-carboxamide
CID 46543736

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 110764330) is 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide is COc1ccc(C(=O)Nc2nc(C)cs2)cc1NC(C)=O.
What is the InChIKey of 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is VWAJTAAXBIBXEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-8-7-21-14(15-8)17-13(19)10-4-5-12(20-3)11(6-10)16-9(2)18/h4-7H,1-3H3,(H,16,18)(H,15,17,19).
What are the key properties of 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 305.36 g/mol, XLogP of 2.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 110764330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).