2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine

C11H23N3S — CID 143328727

IUPAC2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine
SMILESCC1SC=C(C2CCCNC2)N1C.CN
InChIInChI=1S/C10H18N2S.CH5N/c1-8-12(2)10(7-13-8)9-4-3-5-11-6-9;1-2/h7-9,11H,3-6H2,1-2H3;2H2,1H3
InChIKeyGBNHLDJSLFUUSH-UHFFFAOYSA-N
MW229.39 g/mol
LogP1.43
Rot. Bonds1

About 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine

2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine (PubChem CID 143328727) has the molecular formula C11H23N3S and a molecular weight of 229.39 g/mol. Its IUPAC name is 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine.

Molecular Properties

Compound Name2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine
PubChem CID143328727
Molecular FormulaC11H23N3S
Molecular Weight229.39 g/mol
Exact Mass229.16
IUPAC Name2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine
SMILESCC1SC=C(C2CCCNC2)N1C.CN
InChIInChI=1S/C10H18N2S.CH5N/c1-8-12(2)10(7-13-8)9-4-3-5-11-6-9;1-2/h7-9,11H,3-6H2,1-2H3;2H2,1H3
InChIKeyGBNHLDJSLFUUSH-UHFFFAOYSA-N
XLogP1.43
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.39
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-Cyclopropyl-2,3-dihydrothiophen-4-yl)piperazine
CID 54371005
1-(2-Ethyl-2,3-dihydrothiophen-4-yl)piperazine
CID 57130705
4-(1-butylpiperidin-4-yl)-2,3-dimethyl-2H-1,3-thiazole
CID 150538559
2-Ethyl-3-methylidene-1-thia-4,8-diazaspiro[4.5]decane
CID 167067608
4-(1-methylpiperidin-3-yl)-3H-1,3-thiazole-2-thione
CID 116966069
4-(1-methylpiperidin-3-yl)-3H-1,3-thiazol-2-one
CID 116966137
2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole
CID 143328728

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine?
The IUPAC name of 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine (CID 143328727) is 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine.
What is the SMILES notation for 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine?
The canonical SMILES for 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine is CC1SC=C(C2CCCNC2)N1C.CN.
What is the InChIKey of 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine?
The InChIKey is GBNHLDJSLFUUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S.CH5N/c1-8-12(2)10(7-13-8)9-4-3-5-11-6-9;1-2/h7-9,11H,3-6H2,1-2H3;2H2,1H3.
What are the key properties of 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine?
2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine has a molecular weight of 229.39 g/mol, XLogP of 1.43, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4-piperidin-3-yl-2H-1,3-thiazole;methanamine is sourced from PubChem (CID 143328727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).