5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine

C9H15N3S — CID 83108734

IUPAC5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine
SMILESCc1sc(N2CCCCC2)nc1N
InChIInChI=1S/C9H15N3S/c1-7-8(10)11-9(13-7)12-5-3-2-4-6-12/h2-6,10H2,1H3
InChIKeyWLEICICRFIGISR-UHFFFAOYSA-N
MW197.31 g/mol
LogP2.02
Rot. Bonds1

About 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine

5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine (PubChem CID 83108734) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine.

Molecular Properties

Compound Name5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine
PubChem CID83108734
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC Name5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine
SMILESCc1sc(N2CCCCC2)nc1N
InChIInChI=1S/C9H15N3S/c1-7-8(10)11-9(13-7)12-5-3-2-4-6-12/h2-6,10H2,1H3
InChIKeyWLEICICRFIGISR-UHFFFAOYSA-N
XLogP2.02
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine?
The IUPAC name of 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine (CID 83108734) is 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine.
What is the SMILES notation for 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine?
The canonical SMILES for 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine is Cc1sc(N2CCCCC2)nc1N.
What is the InChIKey of 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine?
The InChIKey is WLEICICRFIGISR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c1-7-8(10)11-9(13-7)12-5-3-2-4-6-12/h2-6,10H2,1H3.
What are the key properties of 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine?
5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine has a molecular weight of 197.31 g/mol, XLogP of 2.02, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine is sourced from PubChem (CID 83108734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).