2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide

C17H26N2O2S — CID 136519707

IUPAC2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide
SMILESCc1csc(C2(NC(=O)C3CC(C)OC(C)C3)CCCC2)n1
InChIInChI=1S/C17H26N2O2S/c1-11-10-22-16(18-11)17(6-4-5-7-17)19-15(20)14-8-12(2)21-13(3)9-14/h10,12-14H,4-9H2,1-3H3,(H,19,20)
InChIKeyKRYZJAJAAFCADN-UHFFFAOYSA-N
MW322.47 g/mol
LogP3.54
Rot. Bonds3

About 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide

2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide (PubChem CID 136519707) has the molecular formula C17H26N2O2S and a molecular weight of 322.47 g/mol. Its IUPAC name is 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide
PubChem CID136519707
Molecular FormulaC17H26N2O2S
Molecular Weight322.47 g/mol
Exact Mass322.17
IUPAC Name2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide
SMILESCc1csc(C2(NC(=O)C3CC(C)OC(C)C3)CCCC2)n1
InChIInChI=1S/C17H26N2O2S/c1-11-10-22-16(18-11)17(6-4-5-7-17)19-15(20)14-8-12(2)21-13(3)9-14/h10,12-14H,4-9H2,1-3H3,(H,19,20)
InChIKeyKRYZJAJAAFCADN-UHFFFAOYSA-N
XLogP3.54
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.47
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120976146
N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]pyrrolidine-3-carboxamide
CID 119874183
methyl 2-[[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]carbamoyl]cyclopentane-1-carboxylate
CID 86783848
(6R)-1-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]-4,5,6,7-tetrahydroindazole-6-carboxamide
CID 125141173
2-(methylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide
CID 119887402
4-[[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]carbamoyl]benzoic acid
CID 119185190
2-(1-hydroxycyclohexyl)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide
CID 111520473
1-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-fluorophenyl]-3-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]urea
CID 97073734
2-amino-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]propanamide
CID 119874151
2-(cyclopropylmethylamino)-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]acetamide;dihydrochloride
CID 119887409
N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119887424
N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]-2-pyrrolidin-2-ylacetamide
CID 119874175

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide?
The IUPAC name of 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide (CID 136519707) is 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide is Cc1csc(C2(NC(=O)C3CC(C)OC(C)C3)CCCC2)n1.
What is the InChIKey of 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide?
The InChIKey is KRYZJAJAAFCADN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2S/c1-11-10-22-16(18-11)17(6-4-5-7-17)19-15(20)14-8-12(2)21-13(3)9-14/h10,12-14H,4-9H2,1-3H3,(H,19,20).
What are the key properties of 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide?
2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide has a molecular weight of 322.47 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclopentyl]oxane-4-carboxamide is sourced from PubChem (CID 136519707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).