5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine

C10H17N3S — CID 103362049

IUPAC5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine
SMILESCC1CC(C)CN(c2cc(N)ns2)C1
InChIInChI=1S/C10H17N3S/c1-7-3-8(2)6-13(5-7)10-4-9(11)12-14-10/h4,7-8H,3,5-6H2,1-2H3,(H2,11,12)
InChIKeyGRMXAQUMLWOVPG-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.21
Rot. Bonds1

About 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine

5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine (PubChem CID 103362049) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine.

Molecular Properties

Compound Name5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine
PubChem CID103362049
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine
SMILESCC1CC(C)CN(c2cc(N)ns2)C1
InChIInChI=1S/C10H17N3S/c1-7-3-8(2)6-13(5-7)10-4-9(11)12-14-10/h4,7-8H,3,5-6H2,1-2H3,(H2,11,12)
InChIKeyGRMXAQUMLWOVPG-UHFFFAOYSA-N
XLogP2.21
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine?
The IUPAC name of 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine (CID 103362049) is 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine.
What is the SMILES notation for 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine?
The canonical SMILES for 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine is CC1CC(C)CN(c2cc(N)ns2)C1.
What is the InChIKey of 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine?
The InChIKey is GRMXAQUMLWOVPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-7-3-8(2)6-13(5-7)10-4-9(11)12-14-10/h4,7-8H,3,5-6H2,1-2H3,(H2,11,12).
What are the key properties of 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine?
5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine has a molecular weight of 211.33 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethylpiperidin-1-yl)-1,2-thiazol-3-amine is sourced from PubChem (CID 103362049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).