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

C11H17N3S — CID 43756336

IUPACN-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine
SMILESCCC(C)NCc1c(C)nc2sccn12
InChIInChI=1S/C11H17N3S/c1-4-8(2)12-7-10-9(3)13-11-14(10)5-6-15-11/h5-6,8,12H,4,7H2,1-3H3
InChIKeyKNYCUCWGFPWBPR-UHFFFAOYSA-N
MW223.34 g/mol
LogP2.59
Rot. Bonds4

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

N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine (PubChem CID 43756336) has the molecular formula C11H17N3S and a molecular weight of 223.34 g/mol. Its IUPAC name is N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine.

Molecular Properties

Compound NameN-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine
PubChem CID43756336
Molecular FormulaC11H17N3S
Molecular Weight223.34 g/mol
Exact Mass223.11
IUPAC NameN-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine
SMILESCCC(C)NCc1c(C)nc2sccn12
InChIInChI=1S/C11H17N3S/c1-4-8(2)12-7-10-9(3)13-11-14(10)5-6-15-11/h5-6,8,12H,4,7H2,1-3H3
InChIKeyKNYCUCWGFPWBPR-UHFFFAOYSA-N
XLogP2.59
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]pentan-2-ol
CID 113376077
1-methoxy-3-methyl-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine
CID 65047805
2-methyl-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-1-amine
CID 43756411
1-(2-chlorophenyl)-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-2-amine
CID 43779699
4-methyl-2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]pentan-1-ol
CID 61245388
(1R)-1-(4-methoxyphenyl)-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 81367471
(1S)-1-(2-methoxyphenyl)-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 81389014
2-methyl-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]pentan-2-amine
CID 115621649
3-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]propane-1,2-diol
CID 66178002
N',N'-diethyl-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethane-1,2-diamine
CID 43761768
(2R)-2-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-3-phenylpropan-1-ol
CID 104922935
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine
CID 81333805

Frequently Asked Questions

What is the IUPAC name of N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine?
The IUPAC name of N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine (CID 43756336) is N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine.
What is the SMILES notation for N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine?
The canonical SMILES for N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine is CCC(C)NCc1c(C)nc2sccn12.
What is the InChIKey of N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine?
The InChIKey is KNYCUCWGFPWBPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3S/c1-4-8(2)12-7-10-9(3)13-11-14(10)5-6-15-11/h5-6,8,12H,4,7H2,1-3H3.
What are the key properties of N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine?
N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine has a molecular weight of 223.34 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]butan-2-amine is sourced from PubChem (CID 43756336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).