3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide

C15H18N2O3S — CID 59736022

IUPAC3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCCOc1cc(OCC)cc(C(=O)Nc2ncc(C)s2)c1
InChIInChI=1S/C15H18N2O3S/c1-4-19-12-6-11(7-13(8-12)20-5-2)14(18)17-15-16-9-10(3)21-15/h6-9H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyUHYXUGSDNHVDDN-UHFFFAOYSA-N
MW306.39 g/mol
LogP3.50
Rot. Bonds6

About 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide

3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 59736022) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID59736022
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC Name3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCCOc1cc(OCC)cc(C(=O)Nc2ncc(C)s2)c1
InChIInChI=1S/C15H18N2O3S/c1-4-19-12-6-11(7-13(8-12)20-5-2)14(18)17-15-16-9-10(3)21-15/h6-9H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyUHYXUGSDNHVDDN-UHFFFAOYSA-N
XLogP3.50
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-bromo-4-ethoxy-5-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 4814407
3-amino-4-ethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 61090016
5-ethyl-N-(5-methyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
CID 3363502
4-(ethylamino)-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63210150
3,4-dimethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 2109069
2-amino-6-methyl-N-(5-methyl-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 113378971
4-(ethylamino)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 62165674
4-(4-ethoxyphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 3343017
5-ethoxy-1-ethyl-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)indole-2-carboxamide
CID 110504039
3-(4-ethoxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 47378490
N-(5-cyano-1,3-thiazol-2-yl)-4-ethoxybenzamide
CID 90603554
3-(1-methoxypropoxy)-5-(4-methylsulfonylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 87205538

Frequently Asked Questions

What is the IUPAC name of 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 59736022) is 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide is CCOc1cc(OCC)cc(C(=O)Nc2ncc(C)s2)c1.
What is the InChIKey of 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is UHYXUGSDNHVDDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-4-19-12-6-11(7-13(8-12)20-5-2)14(18)17-15-16-9-10(3)21-15/h6-9H,4-5H2,1-3H3,(H,16,17,18).
What are the key properties of 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 306.39 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 59736022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).