5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine

C9H10N4S2 — CID 115908362

IUPAC5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine
SMILESCSc1ccc(NCc2csnn2)nc1
InChIInChI=1S/C9H10N4S2/c1-14-8-2-3-9(11-5-8)10-4-7-6-15-13-12-7/h2-3,5-6H,4H2,1H3,(H,10,11)
InChIKeySULFMNDTLQEWLO-UHFFFAOYSA-N
MW238.34 g/mol
LogP2.27
Rot. Bonds4

About 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine

5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine (PubChem CID 115908362) has the molecular formula C9H10N4S2 and a molecular weight of 238.34 g/mol. Its IUPAC name is 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine
PubChem CID115908362
Molecular FormulaC9H10N4S2
Molecular Weight238.34 g/mol
Exact Mass238.03
IUPAC Name5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine
SMILESCSc1ccc(NCc2csnn2)nc1
InChIInChI=1S/C9H10N4S2/c1-14-8-2-3-9(11-5-8)10-4-7-6-15-13-12-7/h2-3,5-6H,4H2,1H3,(H,10,11)
InChIKeySULFMNDTLQEWLO-UHFFFAOYSA-N
XLogP2.27
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methylsulfanyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridin-2-amine
CID 115735816
N-[(5-bromothiophen-3-yl)methyl]-5-methylsulfanylpyridin-2-amine
CID 115735843
4-(methylsulfanylmethyl)-N-(thiadiazol-4-ylmethyl)pyridin-2-amine
CID 115908368
1-methyl-N-(thiadiazol-4-ylmethyl)pyrazol-3-amine
CID 60809159
N-methyl-5-methylsulfanylpyridin-2-amine
CID 68974266
2-N,2-N-dimethyl-5-N-(thiadiazol-4-ylmethyl)pyridine-2,5-diamine
CID 43690649
6-methoxy-N-(thiadiazol-4-ylmethyl)pyridin-3-amine
CID 43663789
2,6-difluoro-N-(thiadiazol-4-ylmethyl)aniline
CID 43664102
4-methoxy-N-(thiadiazol-4-ylmethyl)aniline
CID 43663944
3,4-dimethyl-N-(thiadiazol-4-ylmethyl)aniline
CID 43663904
6-(2-methoxyethoxy)-N-(thiadiazol-4-ylmethyl)pyridin-3-amine
CID 43688430
N-(3,3-dimethylbutan-2-yl)-5-methylsulfanylpyridin-2-amine
CID 115921477

Frequently Asked Questions

What is the IUPAC name of 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine?
The IUPAC name of 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine (CID 115908362) is 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine?
The canonical SMILES for 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine is CSc1ccc(NCc2csnn2)nc1.
What is the InChIKey of 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine?
The InChIKey is SULFMNDTLQEWLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4S2/c1-14-8-2-3-9(11-5-8)10-4-7-6-15-13-12-7/h2-3,5-6H,4H2,1H3,(H,10,11).
What are the key properties of 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine?
5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine has a molecular weight of 238.34 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfanyl-N-(thiadiazol-4-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 115908362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).