2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine

C11H18N2S — CID 115027132

IUPAC2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine
SMILESCc1nc(C2(C)CCC2)sc1CCN
InChIInChI=1S/C11H18N2S/c1-8-9(4-7-12)14-10(13-8)11(2)5-3-6-11/h3-7,12H2,1-2H3
InChIKeyZDYYFQMFRSBRCS-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.39
Rot. Bonds3

About 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine

2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine (PubChem CID 115027132) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine
PubChem CID115027132
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine
SMILESCc1nc(C2(C)CCC2)sc1CCN
InChIInChI=1S/C11H18N2S/c1-8-9(4-7-12)14-10(13-8)11(2)5-3-6-11/h3-7,12H2,1-2H3
InChIKeyZDYYFQMFRSBRCS-UHFFFAOYSA-N
XLogP2.39
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(1-methoxycyclopentyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 104611833
3-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]propanoic acid
CID 115043230
2-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethanamine
CID 79002022
[4-ethyl-2-(1-methylcyclopropyl)-1,3-thiazol-5-yl]methanamine
CID 104840968
2-[3-(1-methylcyclobutyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 115015955
[2-(1-methoxy-4,4-dimethylcyclohexyl)-4-methyl-1,3-thiazol-5-yl]methanamine
CID 116777812
2-[2-(2,2-dimethylpropyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 79154268
2-[4-methyl-2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine
CID 82129972
4-methyl-2-(1-methylcyclopentyl)-1,3-thiazole-5-carboxylic acid
CID 115035110
3-[2-(1-methylcyclopentyl)-1,3-thiazol-5-yl]propan-1-amine
CID 115034761
2-[5-(1-methylcyclohexyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 106828748
2-[2-(1-ethoxy-2,2-dimethylpropyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 116730876

Frequently Asked Questions

What is the IUPAC name of 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine?
The IUPAC name of 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine (CID 115027132) is 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine.
What is the SMILES notation for 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine?
The canonical SMILES for 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine is Cc1nc(C2(C)CCC2)sc1CCN.
What is the InChIKey of 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine?
The InChIKey is ZDYYFQMFRSBRCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-9(4-7-12)14-10(13-8)11(2)5-3-6-11/h3-7,12H2,1-2H3.
What are the key properties of 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine?
2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine has a molecular weight of 210.35 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methyl-2-(1-methylcyclobutyl)-1,3-thiazol-5-yl]ethanamine is sourced from PubChem (CID 115027132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).