N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine

C14H22N4O2S2 — CID 124506984

IUPACN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine
SMILESCc1cn2c(CNC3CCN(S(C)(=O)=O)CC3)c(C)nc2s1
InChIInChI=1S/C14H22N4O2S2/c1-10-9-18-13(11(2)16-14(18)21-10)8-15-12-4-6-17(7-5-12)22(3,19)20/h9,12,15H,4-8H2,1-3H3
InChIKeyRFMHCIQTVCRHFD-UHFFFAOYSA-N
MW342.49 g/mol
LogP1.53
Rot. Bonds4

About N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine

N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine (PubChem CID 124506984) has the molecular formula C14H22N4O2S2 and a molecular weight of 342.49 g/mol. Its IUPAC name is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine
PubChem CID124506984
Molecular FormulaC14H22N4O2S2
Molecular Weight342.49 g/mol
Exact Mass342.12
IUPAC NameN-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine
SMILESCc1cn2c(CNC3CCN(S(C)(=O)=O)CC3)c(C)nc2s1
InChIInChI=1S/C14H22N4O2S2/c1-10-9-18-13(11(2)16-14(18)21-10)8-15-12-4-6-17(7-5-12)22(3,19)20/h9,12,15H,4-8H2,1-3H3
InChIKeyRFMHCIQTVCRHFD-UHFFFAOYSA-N
XLogP1.53
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.49
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methylcyclopropan-1-amine
CID 62397504
N-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]methanesulfonamide
CID 43625851
1-methylsulfonyl-N-[(5-methylthiophen-2-yl)methyl]piperidin-4-amine;hydrochloride
CID 47030573
(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanesulfonamide
CID 115000036
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 62841992
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2,5-dimethylpyrrol-1-amine
CID 79101097
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methoxyethanamine
CID 43625696
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 43625709
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]hexan-1-amine
CID 43625829
methyl 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]acetate
CID 43625703
N-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]-2-methylpropanamide
CID 43625807
6-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]hexan-1-ol
CID 103924077

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine?
The IUPAC name of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine (CID 124506984) is N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine.
What is the SMILES notation for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine?
The canonical SMILES for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine is Cc1cn2c(CNC3CCN(S(C)(=O)=O)CC3)c(C)nc2s1.
What is the InChIKey of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine?
The InChIKey is RFMHCIQTVCRHFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2S2/c1-10-9-18-13(11(2)16-14(18)21-10)8-15-12-4-6-17(7-5-12)22(3,19)20/h9,12,15H,4-8H2,1-3H3.
What are the key properties of N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine?
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine has a molecular weight of 342.49 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-methylsulfonylpiperidin-4-amine is sourced from PubChem (CID 124506984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).