[1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine

C11H19N3S — CID 65168676

IUPAC[1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine
SMILESCc1nc(N2CCCCC2CN)sc1C
InChIInChI=1S/C11H19N3S/c1-8-9(2)15-11(13-8)14-6-4-3-5-10(14)7-12/h10H,3-7,12H2,1-2H3
InChIKeyFZBBFGYSIPWNAH-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.08
Rot. Bonds2

About [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine

[1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine (PubChem CID 65168676) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine
PubChem CID65168676
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name[1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine
SMILESCc1nc(N2CCCCC2CN)sc1C
InChIInChI=1S/C11H19N3S/c1-8-9(2)15-11(13-8)14-6-4-3-5-10(14)7-12/h10H,3-7,12H2,1-2H3
InChIKeyFZBBFGYSIPWNAH-UHFFFAOYSA-N
XLogP2.08
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine?
The IUPAC name of [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine (CID 65168676) is [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine.
What is the SMILES notation for [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine?
The canonical SMILES for [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine is Cc1nc(N2CCCCC2CN)sc1C.
What is the InChIKey of [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine?
The InChIKey is FZBBFGYSIPWNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-8-9(2)15-11(13-8)14-6-4-3-5-10(14)7-12/h10H,3-7,12H2,1-2H3.
What are the key properties of [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine?
[1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine has a molecular weight of 225.36 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4,5-dimethyl-1,3-thiazol-2-yl)piperidin-2-yl]methanamine is sourced from PubChem (CID 65168676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).