1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine

C12H19N3S — CID 115333007

IUPAC1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine
SMILESCCC(C)C(C)(N)Cc1cn2ccsc2n1
InChIInChI=1S/C12H19N3S/c1-4-9(2)12(3,13)7-10-8-15-5-6-16-11(15)14-10/h5-6,8-9H,4,7,13H2,1-3H3
InChIKeyMIXHMDHZTNQWTN-UHFFFAOYSA-N
MW237.37 g/mol
LogP2.70
Rot. Bonds4

About 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine

1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine (PubChem CID 115333007) has the molecular formula C12H19N3S and a molecular weight of 237.37 g/mol. Its IUPAC name is 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine.

Molecular Properties

Compound Name1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine
PubChem CID115333007
Molecular FormulaC12H19N3S
Molecular Weight237.37 g/mol
Exact Mass237.13
IUPAC Name1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine
SMILESCCC(C)C(C)(N)Cc1cn2ccsc2n1
InChIInChI=1S/C12H19N3S/c1-4-9(2)12(3,13)7-10-8-15-5-6-16-11(15)14-10/h5-6,8-9H,4,7,13H2,1-3H3
InChIKeyMIXHMDHZTNQWTN-UHFFFAOYSA-N
XLogP2.70
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-propan-2-ylpropane-1,3-diol
CID 115335237
2-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-1-amine
CID 115334306
6-[2-(chloromethyl)-2-ethylbutyl]imidazo[2,1-b][1,3]thiazole
CID 115335151
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine
CID 81333805
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2,3,3-trimethylbutan-1-amine
CID 83142775
2-(4-ethylphenyl)-1-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
CID 115333010
2-ethoxycarbonyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-methylbutanoic acid
CID 103974349
3-ethoxy-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methyl-3-oxopropanoic acid
CID 113360386
1-imidazo[2,1-b][1,3]thiazol-6-yl-2-methyl-3-(2-methylpropylamino)propan-2-ol
CID 113289464
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pentan-3-amine
CID 78925544
6-(3-chloro-2-methylpentyl)imidazo[2,1-b][1,3]thiazole
CID 115334174
4-amino-1-imidazo[2,1-b][1,3]thiazol-6-ylpentan-2-one
CID 116556049

Frequently Asked Questions

What is the IUPAC name of 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine?
The IUPAC name of 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine (CID 115333007) is 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine.
What is the SMILES notation for 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine?
The canonical SMILES for 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine is CCC(C)C(C)(N)Cc1cn2ccsc2n1.
What is the InChIKey of 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine?
The InChIKey is MIXHMDHZTNQWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3S/c1-4-9(2)12(3,13)7-10-8-15-5-6-16-11(15)14-10/h5-6,8-9H,4,7,13H2,1-3H3.
What are the key properties of 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine?
1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine has a molecular weight of 237.37 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethylpentan-2-amine is sourced from PubChem (CID 115333007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).