N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine

C11H14ClN3S2 — CID 75438580

IUPACN-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine
SMILESCN(Cc1c(Cl)nc2sccn12)C1CCSC1
InChIInChI=1S/C11H14ClN3S2/c1-14(8-2-4-16-7-8)6-9-10(12)13-11-15(9)3-5-17-11/h3,5,8H,2,4,6-7H2,1H3
InChIKeyKVJCFEXBFRNBRB-UHFFFAOYSA-N
MW287.84 g/mol
LogP2.99
Rot. Bonds3

About N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine

N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine (PubChem CID 75438580) has the molecular formula C11H14ClN3S2 and a molecular weight of 287.84 g/mol. Its IUPAC name is N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine.

Molecular Properties

Compound NameN-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine
PubChem CID75438580
Molecular FormulaC11H14ClN3S2
Molecular Weight287.84 g/mol
Exact Mass287.03
IUPAC NameN-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine
SMILESCN(Cc1c(Cl)nc2sccn12)C1CCSC1
InChIInChI=1S/C11H14ClN3S2/c1-14(8-2-4-16-7-8)6-9-10(12)13-11-15(9)3-5-17-11/h3,5,8H,2,4,6-7H2,1H3
InChIKeyKVJCFEXBFRNBRB-UHFFFAOYSA-N
XLogP2.99
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.84
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(2-chloro-3-pyridinyl)-N-methylmethanamine
CID 56918257
6-[methyl(thiolan-3-yl)amino]imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 43475632
(E)-but-2-enedioic acid;N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-(2-methylpropyl)piperidin-4-amine
CID 68574574
N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3-(4-fluorophenoxy)-N-methylpropan-1-amine
CID 46994794
N-[(5-chloropyrazin-2-yl)methyl]-N-methylthiolan-3-amine
CID 103054068
N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methylcyclopropan-1-amine;hydrochloride
CID 115614598
7-[[cyclopentyl(methyl)amino]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 51282017
6-chloro-N-methyl-N-(1-methylpiperidin-4-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 60812795
7-[[cyclohexyl(methyl)amino]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 4238274
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(thiolan-3-yl)methanamine
CID 107295391
7-[[methyl-(4-methylcyclohexyl)amino]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 47113217
2-[[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl-cyclopropylamino]propanoic acid
CID 122100367

Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine?
The IUPAC name of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine (CID 75438580) is N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine.
What is the SMILES notation for N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine?
The canonical SMILES for N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine is CN(Cc1c(Cl)nc2sccn12)C1CCSC1.
What is the InChIKey of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine?
The InChIKey is KVJCFEXBFRNBRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3S2/c1-14(8-2-4-16-7-8)6-9-10(12)13-11-15(9)3-5-17-11/h3,5,8H,2,4,6-7H2,1H3.
What are the key properties of N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine?
N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine has a molecular weight of 287.84 g/mol, XLogP of 2.99, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N-methylthiolan-3-amine is sourced from PubChem (CID 75438580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).