4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine

C9H13ClN2OS — CID 83157100

IUPAC4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
SMILESCC1OCCC1N(C)c1nc(Cl)cs1
InChIInChI=1S/C9H13ClN2OS/c1-6-7(3-4-13-6)12(2)9-11-8(10)5-14-9/h5-7H,3-4H2,1-2H3
InChIKeyFZFUZQDBBYCBEY-UHFFFAOYSA-N
MW232.74 g/mol
LogP2.41
Rot. Bonds2

About 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine

4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine (PubChem CID 83157100) has the molecular formula C9H13ClN2OS and a molecular weight of 232.74 g/mol. Its IUPAC name is 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
PubChem CID83157100
Molecular FormulaC9H13ClN2OS
Molecular Weight232.74 g/mol
Exact Mass232.04
IUPAC Name4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
SMILESCC1OCCC1N(C)c1nc(Cl)cs1
InChIInChI=1S/C9H13ClN2OS/c1-6-7(3-4-13-6)12(2)9-11-8(10)5-14-9/h5-7H,3-4H2,1-2H3
InChIKeyFZFUZQDBBYCBEY-UHFFFAOYSA-N
XLogP2.41
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.74
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-(2,5-dimethyloxolan-3-yl)-N-methyl-1,3-thiazol-2-amine
CID 131207453
4-[1-(ethylamino)ethyl]-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
CID 82753671
ethyl 2-[2-[methyl-(2-methyloxolan-3-yl)amino]-1,3-thiazol-4-yl]acetate
CID 82745640
6-chloro-2-N-methyl-2-N-(2-methyloxolan-3-yl)pyridine-2,3-diamine
CID 82741233
2-chloro-N-methyl-N-(2-methyloxolan-3-yl)thieno[2,3-d]pyrimidin-4-amine
CID 103322269
4-chloro-N-(4,4-dimethylcyclohexyl)-N-methyl-1,3-thiazol-2-amine
CID 83157215
4-chloro-N,N-dimethyl-1,3-thiazol-2-amine
CID 68840678
methyl 4-chloro-2-[methyl-(2-methyloxolan-3-yl)amino]-1,3-thiazole-5-carboxylate
CID 82747995
4-chloro-N-methyl-N-(1-methylpyrrolidin-3-yl)-1,3-thiazol-2-amine
CID 130598303
2-N-methyl-2-N-(2-methyloxolan-3-yl)-1,3-benzothiazole-2,6-diamine
CID 82741392
N-methyl-5-[1-(methylamino)ethyl]-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
CID 82754018
1-[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]-1,3-thiazol-5-yl]ethanol
CID 82754565

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine (CID 83157100) is 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine is CC1OCCC1N(C)c1nc(Cl)cs1.
What is the InChIKey of 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
The InChIKey is FZFUZQDBBYCBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN2OS/c1-6-7(3-4-13-6)12(2)9-11-8(10)5-14-9/h5-7H,3-4H2,1-2H3.
What are the key properties of 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine has a molecular weight of 232.74 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 83157100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).