N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide

C12H18N2OS — CID 47047601

IUPACN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
SMILESCCc1nc(NC(=O)C2CCCC2)sc1C
InChIInChI=1S/C12H18N2OS/c1-3-10-8(2)16-12(13-10)14-11(15)9-6-4-5-7-9/h9H,3-7H2,1-2H3,(H,13,14,15)
InChIKeyXABOZEHDBSIAJM-UHFFFAOYSA-N
MW238.36 g/mol
LogP3.14
Rot. Bonds3

About N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide (PubChem CID 47047601) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
PubChem CID47047601
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC NameN-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
SMILESCCc1nc(NC(=O)C2CCCC2)sc1C
InChIInChI=1S/C12H18N2OS/c1-3-10-8(2)16-12(13-10)14-11(15)9-6-4-5-7-9/h9H,3-7H2,1-2H3,(H,13,14,15)
InChIKeyXABOZEHDBSIAJM-UHFFFAOYSA-N
XLogP3.14
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
The IUPAC name of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide (CID 47047601) is N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide is CCc1nc(NC(=O)C2CCCC2)sc1C.
What is the InChIKey of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
The InChIKey is XABOZEHDBSIAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-3-10-8(2)16-12(13-10)14-11(15)9-6-4-5-7-9/h9H,3-7H2,1-2H3,(H,13,14,15).
What are the key properties of N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide?
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide has a molecular weight of 238.36 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide is sourced from PubChem (CID 47047601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).