2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide

C15H24N2OS — CID 166343263

IUPAC2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)NC2(C)CCC(C)(C)C2)s1
InChIInChI=1S/C15H24N2OS/c1-5-6-12-16-9-11(19-12)13(18)17-15(4)8-7-14(2,3)10-15/h9H,5-8,10H2,1-4H3,(H,17,18)
InChIKeyVZBZKHAJHYIHKW-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.79
Rot. Bonds4

About 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide

2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide (PubChem CID 166343263) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide
PubChem CID166343263
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)NC2(C)CCC(C)(C)C2)s1
InChIInChI=1S/C15H24N2OS/c1-5-6-12-16-9-11(19-12)13(18)17-15(4)8-7-14(2,3)10-15/h9H,5-8,10H2,1-4H3,(H,17,18)
InChIKeyVZBZKHAJHYIHKW-UHFFFAOYSA-N
XLogP3.79
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide (CID 166343263) is 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide is CCCc1ncc(C(=O)NC2(C)CCC(C)(C)C2)s1.
What is the InChIKey of 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide?
The InChIKey is VZBZKHAJHYIHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-5-6-12-16-9-11(19-12)13(18)17-15(4)8-7-14(2,3)10-15/h9H,5-8,10H2,1-4H3,(H,17,18).
What are the key properties of 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide?
2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide has a molecular weight of 280.44 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-N-(1,3,3-trimethylcyclopentyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 166343263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).