2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide

C15H18N2O2S — CID 3068074

IUPAC2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide
SMILESCCCNC(=O)c1sc(-c2ccccc2OC)nc1C
InChIInChI=1S/C15H18N2O2S/c1-4-9-16-14(18)13-10(2)17-15(20-13)11-7-5-6-8-12(11)19-3/h5-8H,4,9H2,1-3H3,(H,16,18)
InChIKeyUKEXUOFKPZTJSJ-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.27
Rot. Bonds5

About 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide

2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide (PubChem CID 3068074) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide
PubChem CID3068074
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Name2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide
SMILESCCCNC(=O)c1sc(-c2ccccc2OC)nc1C
InChIInChI=1S/C15H18N2O2S/c1-4-9-16-14(18)13-10(2)17-15(20-13)11-7-5-6-8-12(11)19-3/h5-8H,4,9H2,1-3H3,(H,16,18)
InChIKeyUKEXUOFKPZTJSJ-UHFFFAOYSA-N
XLogP3.27
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide (CID 3068074) is 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide is CCCNC(=O)c1sc(-c2ccccc2OC)nc1C.
What is the InChIKey of 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide?
The InChIKey is UKEXUOFKPZTJSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-4-9-16-14(18)13-10(2)17-15(20-13)11-7-5-6-8-12(11)19-3/h5-8H,4,9H2,1-3H3,(H,16,18).
What are the key properties of 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide?
2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide has a molecular weight of 290.39 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-4-methyl-N-propyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 3068074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).