N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine

C10H15N3S — CID 81333805

IUPACN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine
SMILESCCC(C)NCc1cn2ccsc2n1
InChIInChI=1S/C10H15N3S/c1-3-8(2)11-6-9-7-13-4-5-14-10(13)12-9/h4-5,7-8,11H,3,6H2,1-2H3
InChIKeySXWGESFWJXFMGP-UHFFFAOYSA-N
MW209.32 g/mol
LogP2.28
Rot. Bonds4

About N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine

N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine (PubChem CID 81333805) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine.

Molecular Properties

Compound NameN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine
PubChem CID81333805
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC NameN-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine
SMILESCCC(C)NCc1cn2ccsc2n1
InChIInChI=1S/C10H15N3S/c1-3-8(2)11-6-9-7-13-4-5-14-10(13)12-9/h4-5,7-8,11H,3,6H2,1-2H3
InChIKeySXWGESFWJXFMGP-UHFFFAOYSA-N
XLogP2.28
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.32
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)pentan-3-amine
CID 78925544
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)-3-methylbutan-2-amine
CID 81334513
1-cyclopropyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propan-2-amine
CID 81333671
2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)butan-1-ol
CID 115331507
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)-3-methoxybutan-2-amine
CID 115713221
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methylpropan-1-amine
CID 115331414
(1S)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-1-(4-methylphenyl)ethanamine
CID 115331752
(1R)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-1-pyridin-2-ylethanamine
CID 115331781
(1R)-1-(4-fluorophenyl)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)propan-1-amine
CID 97230778
(1S)-1-(4-chlorophenyl)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)ethanamine
CID 115331754

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine?
The IUPAC name of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine (CID 81333805) is N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine.
What is the SMILES notation for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine?
The canonical SMILES for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine is CCC(C)NCc1cn2ccsc2n1.
What is the InChIKey of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine?
The InChIKey is SXWGESFWJXFMGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c1-3-8(2)11-6-9-7-13-4-5-14-10(13)12-9/h4-5,7-8,11H,3,6H2,1-2H3.
What are the key properties of N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine?
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine has a molecular weight of 209.32 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)butan-2-amine is sourced from PubChem (CID 81333805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).