(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine

C10H12N4S — CID 166760947

IUPAC(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine
SMILESCc1cc(-c2nsc([C@@H](C)N)n2)ccn1
InChIInChI=1S/C10H12N4S/c1-6-5-8(3-4-12-6)9-13-10(7(2)11)15-14-9/h3-5,7H,11H2,1-2H3/t7-/m1/s1
InChIKeyMWDPTTNEYHWEFF-SSDOTTSWSA-N
MW220.30 g/mol
LogP1.93
Rot. Bonds2

About (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine

(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine (PubChem CID 166760947) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine
PubChem CID166760947
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC Name(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine
SMILESCc1cc(-c2nsc([C@@H](C)N)n2)ccn1
InChIInChI=1S/C10H12N4S/c1-6-5-8(3-4-12-6)9-13-10(7(2)11)15-14-9/h3-5,7H,11H2,1-2H3/t7-/m1/s1
InChIKeyMWDPTTNEYHWEFF-SSDOTTSWSA-N
XLogP1.93
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-N-[(1S)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethyl]-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 166760955
1-methyl-N-[(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethyl]-4-(trifluoromethyl)pyrrole-2-carboxamide
CID 168679349
1-[5-(2-methyl-4-pyridinyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 106754014
4-(2-methyl-4-pyridinyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 113482951
4-chloro-6-(2-methyl-4-pyridinyl)-1,3,5-triazin-2-amine
CID 106754507
1-(4-methyl-1,3-thiazol-2-yl)ethanamine;hydrochloride
CID 73012335
2-(1-amino-2-methylpropyl)-6-(2-methyl-4-pyridinyl)-3H-thieno[3,2-d]pyrimidin-4-one;hydrochloride
CID 146371601
4-(2,6-dimethylphenyl)-2-methylpyridine
CID 126725908
3-(2-methyl-4-pyridinyl)-5-[4-(2-phenylethyl)piperazin-1-yl]-1,2,4-thiadiazole
CID 71187229
(S)-N-[(1R)-1-[3-(2-cyclopropyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethyl]-2-methylpropane-2-sulfinamide
CID 166761077
4-methyl-6-(2-methyl-4-pyridinyl)pyrimidin-2-amine
CID 71225444
2-methyl-4-(2-methyl-4-pyridinyl)pyrimidine
CID 71302575

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine?
The IUPAC name of (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine (CID 166760947) is (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine.
What is the SMILES notation for (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine?
The canonical SMILES for (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine is Cc1cc(-c2nsc([C@@H](C)N)n2)ccn1.
What is the InChIKey of (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine?
The InChIKey is MWDPTTNEYHWEFF-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H12N4S/c1-6-5-8(3-4-12-6)9-13-10(7(2)11)15-14-9/h3-5,7H,11H2,1-2H3/t7-/m1/s1.
What are the key properties of (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine?
(1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine has a molecular weight of 220.30 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[3-(2-methyl-4-pyridinyl)-1,2,4-thiadiazol-5-yl]ethanamine is sourced from PubChem (CID 166760947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).