N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide

C19H24N2O3S — CID 86941565

IUPACN-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide
SMILESCOc1ccccc1-c1csc(NC(=O)COC2CCCC(C)C2)n1
InChIInChI=1S/C19H24N2O3S/c1-13-6-5-7-14(10-13)24-11-18(22)21-19-20-16(12-25-19)15-8-3-4-9-17(15)23-2/h3-4,8-9,12-14H,5-7,10-11H2,1-2H3,(H,20,21,22)
InChIKeyOSYPFFQHGUEPIU-UHFFFAOYSA-N
MW360.48 g/mol
LogP4.35
Rot. Bonds6

About N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide

N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide (PubChem CID 86941565) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide.

Molecular Properties

Compound NameN-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide
PubChem CID86941565
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide
SMILESCOc1ccccc1-c1csc(NC(=O)COC2CCCC(C)C2)n1
InChIInChI=1S/C19H24N2O3S/c1-13-6-5-7-14(10-13)24-11-18(22)21-19-20-16(12-25-19)15-8-3-4-9-17(15)23-2/h3-4,8-9,12-14H,5-7,10-11H2,1-2H3,(H,20,21,22)
InChIKeyOSYPFFQHGUEPIU-UHFFFAOYSA-N
XLogP4.35
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide?
The IUPAC name of N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide (CID 86941565) is N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide.
What is the SMILES notation for N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide?
The canonical SMILES for N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide is COc1ccccc1-c1csc(NC(=O)COC2CCCC(C)C2)n1.
What is the InChIKey of N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide?
The InChIKey is OSYPFFQHGUEPIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-13-6-5-7-14(10-13)24-11-18(22)21-19-20-16(12-25-19)15-8-3-4-9-17(15)23-2/h3-4,8-9,12-14H,5-7,10-11H2,1-2H3,(H,20,21,22).
What are the key properties of N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide?
N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide has a molecular weight of 360.48 g/mol, XLogP of 4.35, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-2-(3-methylcyclohexyl)oxyacetamide is sourced from PubChem (CID 86941565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).