2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol

C10H15N3OS — CID 115331507

IUPAC2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol
SMILESCCC(CO)NCc1cn2ccsc2n1
InChIInChI=1S/C10H15N3OS/c1-2-8(7-14)11-5-9-6-13-3-4-15-10(13)12-9/h3-4,6,8,11,14H,2,5,7H2,1H3
InChIKeyRKDBXGGCYSAFTR-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.26
Rot. Bonds5

About 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol

2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol (PubChem CID 115331507) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol.

Molecular Properties

Compound Name2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol
PubChem CID115331507
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol
SMILESCCC(CO)NCc1cn2ccsc2n1
InChIInChI=1S/C10H15N3OS/c1-2-8(7-14)11-5-9-6-13-3-4-15-10(13)12-9/h3-4,6,8,11,14H,2,5,7H2,1H3
InChIKeyRKDBXGGCYSAFTR-UHFFFAOYSA-N
XLogP1.26
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pentan-3-amine
CID 78925544
2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)-3-methoxypropan-1-ol
CID 106190367
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-1-methoxybutan-2-amine
CID 81333206
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)-3-methylbutan-2-amine
CID 81334513
5-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)-2-methylpentan-1-ol
CID 106160046
2-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-1-N,1-N,4-trimethylpentane-1,2-diamine
CID 115331568
4-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-2-ol
CID 115331674
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-3-methoxybutan-2-amine
CID 115713221
4-chloro-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine
CID 83187591
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methylpropan-1-amine
CID 115331414
1-cyclopropyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propan-2-amine
CID 81333671

Frequently Asked Questions

What is the IUPAC name of 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol?
The IUPAC name of 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol (CID 115331507) is 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol.
What is the SMILES notation for 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol?
The canonical SMILES for 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol is CCC(CO)NCc1cn2ccsc2n1.
What is the InChIKey of 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol?
The InChIKey is RKDBXGGCYSAFTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-2-8(7-14)11-5-9-6-13-3-4-15-10(13)12-9/h3-4,6,8,11,14H,2,5,7H2,1H3.
What are the key properties of 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol?
2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol has a molecular weight of 225.32 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol is sourced from PubChem (CID 115331507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).