N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine

C9H19N3S — CID 163745786

IUPACN-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine
SMILESCNC1CNC(C2CCCNC2)S1
InChIInChI=1S/C9H19N3S/c1-10-8-6-12-9(13-8)7-3-2-4-11-5-7/h7-12H,2-6H2,1H3
InChIKeyLLSYPKQVWQUHRD-UHFFFAOYSA-N
MW201.34 g/mol
LogP0.19
Rot. Bonds2

About N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine

N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine (PubChem CID 163745786) has the molecular formula C9H19N3S and a molecular weight of 201.34 g/mol. Its IUPAC name is N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine.

Molecular Properties

Compound NameN-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine
PubChem CID163745786
Molecular FormulaC9H19N3S
Molecular Weight201.34 g/mol
Exact Mass201.13
IUPAC NameN-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine
SMILESCNC1CNC(C2CCCNC2)S1
InChIInChI=1S/C9H19N3S/c1-10-8-6-12-9(13-8)7-3-2-4-11-5-7/h7-12H,2-6H2,1H3
InChIKeyLLSYPKQVWQUHRD-UHFFFAOYSA-N
XLogP0.19
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.34
LogP ≤ 50.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine?
The IUPAC name of N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine (CID 163745786) is N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine.
What is the SMILES notation for N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine?
The canonical SMILES for N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine is CNC1CNC(C2CCCNC2)S1.
What is the InChIKey of N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine?
The InChIKey is LLSYPKQVWQUHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3S/c1-10-8-6-12-9(13-8)7-3-2-4-11-5-7/h7-12H,2-6H2,1H3.
What are the key properties of N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine?
N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine has a molecular weight of 201.34 g/mol, XLogP of 0.19, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-piperidin-3-yl-1,3-thiazolidin-5-amine is sourced from PubChem (CID 163745786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).