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

C11H16N4S — CID 115332601

IUPACN-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine
SMILESCCN(Cc1cn2ccsc2n1)C1CNC1
InChIInChI=1S/C11H16N4S/c1-2-14(10-5-12-6-10)7-9-8-15-3-4-16-11(15)13-9/h3-4,8,10,12H,2,5-7H2,1H3
InChIKeyADUPVANODSBBGB-UHFFFAOYSA-N
MW236.34 g/mol
LogP1.19
Rot. Bonds4

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

N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine (PubChem CID 115332601) has the molecular formula C11H16N4S and a molecular weight of 236.34 g/mol. Its IUPAC name is N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine.

Molecular Properties

Compound NameN-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine
PubChem CID115332601
Molecular FormulaC11H16N4S
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC NameN-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine
SMILESCCN(Cc1cn2ccsc2n1)C1CNC1
InChIInChI=1S/C11H16N4S/c1-2-14(10-5-12-6-10)7-9-8-15-3-4-16-11(15)13-9/h3-4,8,10,12H,2,5-7H2,1H3
InChIKeyADUPVANODSBBGB-UHFFFAOYSA-N
XLogP1.19
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-chloroethyl)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclobutanamine
CID 102861387
N'-cyclopentyl-N'-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)ethane-1,2-diamine
CID 113288909
3-[cyclopropyl(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)amino]propanenitrile
CID 79004072
3-(azetidin-3-yl)-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-one
CID 116680767
1-(azetidin-3-yl)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-one
CID 116582461
6-[(3-ethylazetidin-3-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115335298
6-[(2-ethylpiperazin-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 113288915
2-[ethyl(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)amino]-2-methylpropanoic acid
CID 113288980
2-[(1,1-dioxothiolan-3-yl)-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)amino]acetic acid
CID 115332428
N-ethyl-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]azetidin-3-amine
CID 66181500
1-[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclobutyl]-N-methylmethanamine
CID 115334382
6-(chloromethyl)imidazo[2,1-b][1,3]thiazole
CID 18804066

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine?
The IUPAC name of N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine (CID 115332601) is N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine.
What is the SMILES notation for N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine?
The canonical SMILES for N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine is CCN(Cc1cn2ccsc2n1)C1CNC1.
What is the InChIKey of N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine?
The InChIKey is ADUPVANODSBBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4S/c1-2-14(10-5-12-6-10)7-9-8-15-3-4-16-11(15)13-9/h3-4,8,10,12H,2,5-7H2,1H3.
What are the key properties of N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine?
N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine has a molecular weight of 236.34 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine is sourced from PubChem (CID 115332601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).