3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide

C19H24N2O3S — CID 8873226

IUPAC3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
SMILESCOc1ccc(OC)c(-c2csc(NC(=O)CCC3CCCC3)n2)c1
InChIInChI=1S/C19H24N2O3S/c1-23-14-8-9-17(24-2)15(11-14)16-12-25-19(20-16)21-18(22)10-7-13-5-3-4-6-13/h8-9,11-13H,3-7,10H2,1-2H3,(H,20,21,22)
InChIKeyJCUAHJMLCPOWGF-UHFFFAOYSA-N
MW360.48 g/mol
LogP4.74
Rot. Bonds7

About 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide

3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide (PubChem CID 8873226) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
PubChem CID8873226
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
SMILESCOc1ccc(OC)c(-c2csc(NC(=O)CCC3CCCC3)n2)c1
InChIInChI=1S/C19H24N2O3S/c1-23-14-8-9-17(24-2)15(11-14)16-12-25-19(20-16)21-18(22)10-7-13-5-3-4-6-13/h8-9,11-13H,3-7,10H2,1-2H3,(H,20,21,22)
InChIKeyJCUAHJMLCPOWGF-UHFFFAOYSA-N
XLogP4.74
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide (CID 8873226) is 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide is COc1ccc(OC)c(-c2csc(NC(=O)CCC3CCCC3)n2)c1.
What is the InChIKey of 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
The InChIKey is JCUAHJMLCPOWGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-23-14-8-9-17(24-2)15(11-14)16-12-25-19(20-16)21-18(22)10-7-13-5-3-4-6-13/h8-9,11-13H,3-7,10H2,1-2H3,(H,20,21,22).
What are the key properties of 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide has a molecular weight of 360.48 g/mol, XLogP of 4.74, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide is sourced from PubChem (CID 8873226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).