4-chloro-N,N-dimethyl-1,3-thiazol-2-amine

C5H7ClN2S — CID 68840678

IUPAC4-chloro-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1nc(Cl)cs1
InChIInChI=1S/C5H7ClN2S/c1-8(2)5-7-4(6)3-9-5/h3H,1-2H3
InChIKeyHRZIHPZRWBIRSA-UHFFFAOYSA-N
MW162.65 g/mol
LogP1.86
Rot. Bonds1

About 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine

4-chloro-N,N-dimethyl-1,3-thiazol-2-amine (PubChem CID 68840678) has the molecular formula C5H7ClN2S and a molecular weight of 162.65 g/mol. Its IUPAC name is 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-chloro-N,N-dimethyl-1,3-thiazol-2-amine
PubChem CID68840678
Molecular FormulaC5H7ClN2S
Molecular Weight162.65 g/mol
Exact Mass162.00
IUPAC Name4-chloro-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1nc(Cl)cs1
InChIInChI=1S/C5H7ClN2S/c1-8(2)5-7-4(6)3-9-5/h3H,1-2H3
InChIKeyHRZIHPZRWBIRSA-UHFFFAOYSA-N
XLogP1.86
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.65
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-ethyl-1,3-thiazol-2-amine
CID 83157418
2-Amino-4-chlorothiazole
CID 9833972
2-N,2-N,4-N,4-N-tetramethyl-1,3-thiazole-2,4-diamine
CID 12488407
N2,N2-dimethylthiazole-2,4-diamine
CID 12576623
Amino-4-dimethylaminothiazole
CID 20299899
4-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 83155974
4-chloro-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 83156445
4-chloro-N-methyl-N-(3,3,3-trifluoropropyl)-1,3-thiazol-2-amine
CID 83156607
4-chloro-N-propyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 83156710
4-chloro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 83156828
4-chloro-N-(2,2-difluoroethyl)-N-methyl-1,3-thiazol-2-amine
CID 116316412
4-chloro-N-(2-fluoroethyl)-1,3-thiazol-2-amine
CID 130504198

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine?
The IUPAC name of 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine (CID 68840678) is 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine is CN(C)c1nc(Cl)cs1.
What is the InChIKey of 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine?
The InChIKey is HRZIHPZRWBIRSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7ClN2S/c1-8(2)5-7-4(6)3-9-5/h3H,1-2H3.
What are the key properties of 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine?
4-chloro-N,N-dimethyl-1,3-thiazol-2-amine has a molecular weight of 162.65 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N,N-dimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 68840678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).