4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine

C14H23N3S — CID 113289514

IUPAC4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine
SMILESCCCNCC(C)C(C)Cc1cn2ccsc2n1
InChIInChI=1S/C14H23N3S/c1-4-5-15-9-12(3)11(2)8-13-10-17-6-7-18-14(17)16-13/h6-7,10-12,15H,4-5,8-9H2,1-3H3
InChIKeyUWUVVSOUFOAYLJ-UHFFFAOYSA-N
MW265.43 g/mol
LogP3.21
Rot. Bonds7

About 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine

4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine (PubChem CID 113289514) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine.

Molecular Properties

Compound Name4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine
PubChem CID113289514
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine
SMILESCCCNCC(C)C(C)Cc1cn2ccsc2n1
InChIInChI=1S/C14H23N3S/c1-4-5-15-9-12(3)11(2)8-13-10-17-6-7-18-14(17)16-13/h6-7,10-12,15H,4-5,8-9H2,1-3H3
InChIKeyUWUVVSOUFOAYLJ-UHFFFAOYSA-N
XLogP3.21
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-N-propylpentan-1-amine
CID 113289314
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-methyl-N-propylpentan-2-amine
CID 115332398
6-(3-chloro-2-methylpentyl)imidazo[2,1-b][1,3]thiazole
CID 115334174
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propan-2-ylsulfanyl-N-propylpropan-2-amine
CID 115333706
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methylpropan-1-amine
CID 115331414
N-(2-cyclopentyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropyl)-2-methylpropan-1-amine
CID 115926891
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-methylsulfonyl-N-propylbutan-2-amine
CID 105023459
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2,3,3-trimethylbutan-1-amine
CID 83142775
N-(2-imidazo[2,1-b][1,3]thiazol-6-yl-1-phenylethyl)propan-1-amine
CID 115333467
6-imidazo[2,1-b][1,3]thiazol-6-yl-2-methyl-N-propylhexan-3-amine
CID 115334726
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methylsulfanyl-N-propylbutan-2-amine
CID 105174072
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-methoxy-4,4-dimethyl-N-propylpentan-2-amine
CID 116725116

Frequently Asked Questions

What is the IUPAC name of 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine?
The IUPAC name of 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine (CID 113289514) is 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine.
What is the SMILES notation for 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine?
The canonical SMILES for 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine is CCCNCC(C)C(C)Cc1cn2ccsc2n1.
What is the InChIKey of 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine?
The InChIKey is UWUVVSOUFOAYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3S/c1-4-5-15-9-12(3)11(2)8-13-10-17-6-7-18-14(17)16-13/h6-7,10-12,15H,4-5,8-9H2,1-3H3.
What are the key properties of 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine?
4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine has a molecular weight of 265.43 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[2,1-b][1,3]thiazol-6-yl-2,3-dimethyl-N-propylbutan-1-amine is sourced from PubChem (CID 113289514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).