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

C16H18N2O2S — CID 167779770

IUPAC2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide
SMILESCc1ncc(NC(=O)c2ccccc2OC2CCCC2)s1
InChIInChI=1S/C16H18N2O2S/c1-11-17-10-15(21-11)18-16(19)13-8-4-5-9-14(13)20-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7H2,1H3,(H,18,19)
InChIKeyXUIKKMXYOZEOFG-UHFFFAOYSA-N
MW302.40 g/mol
LogP4.03
Rot. Bonds4

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

2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide (PubChem CID 167779770) has the molecular formula C16H18N2O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide.

Molecular Properties

Compound Name2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide
PubChem CID167779770
Molecular FormulaC16H18N2O2S
Molecular Weight302.40 g/mol
Exact Mass302.11
IUPAC Name2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide
SMILESCc1ncc(NC(=O)c2ccccc2OC2CCCC2)s1
InChIInChI=1S/C16H18N2O2S/c1-11-17-10-15(21-11)18-16(19)13-8-4-5-9-14(13)20-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7H2,1H3,(H,18,19)
InChIKeyXUIKKMXYOZEOFG-UHFFFAOYSA-N
XLogP4.03
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide?
The IUPAC name of 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide (CID 167779770) is 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide.
What is the SMILES notation for 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide?
The canonical SMILES for 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide is Cc1ncc(NC(=O)c2ccccc2OC2CCCC2)s1.
What is the InChIKey of 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide?
The InChIKey is XUIKKMXYOZEOFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2S/c1-11-17-10-15(21-11)18-16(19)13-8-4-5-9-14(13)20-12-6-2-3-7-12/h4-5,8-10,12H,2-3,6-7H2,1H3,(H,18,19).
What are the key properties of 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide?
2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide has a molecular weight of 302.40 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-N-(2-methyl-1,3-thiazol-5-yl)benzamide is sourced from PubChem (CID 167779770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).