2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol

C6H11N3OS — CID 65273209

IUPAC2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol
SMILESCc1nsc(N(C)CCO)n1
InChIInChI=1S/C6H11N3OS/c1-5-7-6(11-8-5)9(2)3-4-10/h10H,3-4H2,1-2H3
InChIKeyDNWDMZRDYGQKBI-UHFFFAOYSA-N
MW173.24 g/mol
LogP0.28
Rot. Bonds3

About 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol

2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol (PubChem CID 65273209) has the molecular formula C6H11N3OS and a molecular weight of 173.24 g/mol. Its IUPAC name is 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol
PubChem CID65273209
Molecular FormulaC6H11N3OS
Molecular Weight173.24 g/mol
Exact Mass173.06
IUPAC Name2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol
SMILESCc1nsc(N(C)CCO)n1
InChIInChI=1S/C6H11N3OS/c1-5-7-6(11-8-5)9(2)3-4-10/h10H,3-4H2,1-2H3
InChIKeyDNWDMZRDYGQKBI-UHFFFAOYSA-N
XLogP0.28
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-Methyl-1,2,4-thiadiazol-5-yl)methanol
CID 91647791
2-[Propan-2-yl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethanol
CID 107305659
2-[Methyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethanol
CID 107305667
2-[Ethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethanol
CID 107305672
2-[2-Hydroxyethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethanol
CID 107305676
2-[Propyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethanol
CID 107305679
2-[Butyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethanol
CID 107305680
1-[Methyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]propan-2-ol
CID 107305690
2-[Methyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]propan-1-ol
CID 107305729
2-[2,2-Difluoroethyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethanol
CID 107484087
2-[2,2-Difluoroethyl-(3-ethyl-1,2,4-thiadiazol-5-yl)amino]ethanol
CID 107484110
2-[2,2-Difluoroethyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]ethanol
CID 107484111

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
The IUPAC name of 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol (CID 65273209) is 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol.
What is the SMILES notation for 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
The canonical SMILES for 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol is Cc1nsc(N(C)CCO)n1.
What is the InChIKey of 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
The InChIKey is DNWDMZRDYGQKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3OS/c1-5-7-6(11-8-5)9(2)3-4-10/h10H,3-4H2,1-2H3.
What are the key properties of 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol?
2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol has a molecular weight of 173.24 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(3-methyl-1,2,4-thiadiazol-5-yl)amino]ethanol is sourced from PubChem (CID 65273209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).