ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide

C13H22N2OS — CID 143608697

IUPACethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide
SMILESCC.Cc1csc(NC(=O)C2CCCCC2)n1
InChIInChI=1S/C11H16N2OS.C2H6/c1-8-7-15-11(12-8)13-10(14)9-5-3-2-4-6-9;1-2/h7,9H,2-6H2,1H3,(H,12,13,14);1-2H3
InChIKeyUIQGNIOPSBCFNM-UHFFFAOYSA-N
MW254.40 g/mol
LogP4.00
Rot. Bonds2

About ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide

ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide (PubChem CID 143608697) has the molecular formula C13H22N2OS and a molecular weight of 254.40 g/mol. Its IUPAC name is ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide.

Molecular Properties

Compound Nameethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide
PubChem CID143608697
Molecular FormulaC13H22N2OS
Molecular Weight254.40 g/mol
Exact Mass254.15
IUPAC Nameethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide
SMILESCC.Cc1csc(NC(=O)C2CCCCC2)n1
InChIInChI=1S/C11H16N2OS.C2H6/c1-8-7-15-11(12-8)13-10(14)9-5-3-2-4-6-9;1-2/h7,9H,2-6H2,1H3,(H,12,13,14);1-2H3
InChIKeyUIQGNIOPSBCFNM-UHFFFAOYSA-N
XLogP4.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.40
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,3S)-1-N,3-N-bis(4-methyl-1,3-thiazol-2-yl)cyclohexane-1,3-dicarboxamide
CID 52526965
1-cyclohexyl-3-(4-methyl-1,3-thiazol-2-yl)urea
CID 4129191
tert-butyl 3-[(4-methyl-1,3-thiazol-2-yl)carbamoyl]piperidine-1-carboxylate
CID 47016276
N-cycloheptyl-N'-(4-methyl-1,3-thiazol-2-yl)oxamide
CID 44997302
9-amino-N-(4-methyl-1,3-thiazol-2-yl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120984385
4-(cyclopropanecarbonylamino)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 17361667
1-(3-methylbut-2-enoyl)-N-(4-methyl-1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 51090788
N-(4-methyl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 18072813
(2S)-N-(4-methyl-1,3-thiazol-2-yl)oxolane-2-carboxamide
CID 1086809
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 733842
4-(tert-butylsulfonylamino)-N-(4-methyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide
CID 20630708
N-[4-(2-aminoethyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 28803745

Frequently Asked Questions

What is the IUPAC name of ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide?
The IUPAC name of ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide (CID 143608697) is ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide.
What is the SMILES notation for ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide?
The canonical SMILES for ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide is CC.Cc1csc(NC(=O)C2CCCCC2)n1.
What is the InChIKey of ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide?
The InChIKey is UIQGNIOPSBCFNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS.C2H6/c1-8-7-15-11(12-8)13-10(14)9-5-3-2-4-6-9;1-2/h7,9H,2-6H2,1H3,(H,12,13,14);1-2H3.
What are the key properties of ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide?
ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide has a molecular weight of 254.40 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(4-methyl-1,3-thiazol-2-yl)cyclohexanecarboxamide is sourced from PubChem (CID 143608697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).