1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine

C9H15N3S — CID 43556525

IUPAC1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine
SMILESNC1CCN(Cc2cscn2)CC1
InChIInChI=1S/C9H15N3S/c10-8-1-3-12(4-2-8)5-9-6-13-7-11-9/h6-8H,1-5,10H2
InChIKeyZPKPHJNCLOOIBD-UHFFFAOYSA-N
MW197.31 g/mol
LogP1.07
Rot. Bonds2

About 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine

1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine (PubChem CID 43556525) has the molecular formula C9H15N3S and a molecular weight of 197.31 g/mol. Its IUPAC name is 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine
PubChem CID43556525
Molecular FormulaC9H15N3S
Molecular Weight197.31 g/mol
Exact Mass197.10
IUPAC Name1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine
SMILESNC1CCN(Cc2cscn2)CC1
InChIInChI=1S/C9H15N3S/c10-8-1-3-12(4-2-8)5-9-6-13-7-11-9/h6-8H,1-5,10H2
InChIKeyZPKPHJNCLOOIBD-UHFFFAOYSA-N
XLogP1.07
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.31
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine?
The IUPAC name of 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine (CID 43556525) is 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine?
The canonical SMILES for 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine is NC1CCN(Cc2cscn2)CC1.
What is the InChIKey of 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine?
The InChIKey is ZPKPHJNCLOOIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3S/c10-8-1-3-12(4-2-8)5-9-6-13-7-11-9/h6-8H,1-5,10H2.
What are the key properties of 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine?
1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine has a molecular weight of 197.31 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-thiazol-4-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 43556525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).