N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine

C15H24N4S — CID 43476226

IUPACN-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
SMILESCC(C)NCc1c(N2CCCCC2C)nc2sccn12
InChIInChI=1S/C15H24N4S/c1-11(2)16-10-13-14(17-15-19(13)8-9-20-15)18-7-5-4-6-12(18)3/h8-9,11-12,16H,4-7,10H2,1-3H3
InChIKeyCHUXDBIEWMNMTN-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.27
Rot. Bonds4

About N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine

N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine (PubChem CID 43476226) has the molecular formula C15H24N4S and a molecular weight of 292.45 g/mol. Its IUPAC name is N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
PubChem CID43476226
Molecular FormulaC15H24N4S
Molecular Weight292.45 g/mol
Exact Mass292.17
IUPAC NameN-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
SMILESCC(C)NCc1c(N2CCCCC2C)nc2sccn12
InChIInChI=1S/C15H24N4S/c1-11(2)16-10-13-14(17-15-19(13)8-9-20-15)18-7-5-4-6-12(18)3/h8-9,11-12,16H,4-7,10H2,1-3H3
InChIKeyCHUXDBIEWMNMTN-UHFFFAOYSA-N
XLogP3.27
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine?
The IUPAC name of N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine (CID 43476226) is N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine is CC(C)NCc1c(N2CCCCC2C)nc2sccn12.
What is the InChIKey of N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine?
The InChIKey is CHUXDBIEWMNMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4S/c1-11(2)16-10-13-14(17-15-19(13)8-9-20-15)18-7-5-4-6-12(18)3/h8-9,11-12,16H,4-7,10H2,1-3H3.
What are the key properties of N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine?
N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine has a molecular weight of 292.45 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine is sourced from PubChem (CID 43476226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).