(2-methylsulfanyl-4-pyridinyl)methanamine

C7H10N2S — CID 61023047

IUPAC(2-methylsulfanyl-4-pyridinyl)methanamine
SMILESCSc1cc(CN)ccn1
InChIInChI=1S/C7H10N2S/c1-10-7-4-6(5-8)2-3-9-7/h2-4H,5,8H2,1H3
InChIKeyWUQAMFZTFZEJDD-UHFFFAOYSA-N
MW154.24 g/mol
LogP1.26
Rot. Bonds2

About (2-methylsulfanyl-4-pyridinyl)methanamine

(2-methylsulfanyl-4-pyridinyl)methanamine (PubChem CID 61023047) has the molecular formula C7H10N2S and a molecular weight of 154.24 g/mol. Its IUPAC name is (2-methylsulfanyl-4-pyridinyl)methanamine.

Molecular Properties

Compound Name(2-methylsulfanyl-4-pyridinyl)methanamine
PubChem CID61023047
Molecular FormulaC7H10N2S
Molecular Weight154.24 g/mol
Exact Mass154.06
IUPAC Name(2-methylsulfanyl-4-pyridinyl)methanamine
SMILESCSc1cc(CN)ccn1
InChIInChI=1S/C7H10N2S/c1-10-7-4-6(5-8)2-3-9-7/h2-4H,5,8H2,1H3
InChIKeyWUQAMFZTFZEJDD-UHFFFAOYSA-N
XLogP1.26
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.24
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-methylsulfanyl-4-pyridinyl)methanamine?
The IUPAC name of (2-methylsulfanyl-4-pyridinyl)methanamine (CID 61023047) is (2-methylsulfanyl-4-pyridinyl)methanamine.
What is the SMILES notation for (2-methylsulfanyl-4-pyridinyl)methanamine?
The canonical SMILES for (2-methylsulfanyl-4-pyridinyl)methanamine is CSc1cc(CN)ccn1.
What is the InChIKey of (2-methylsulfanyl-4-pyridinyl)methanamine?
The InChIKey is WUQAMFZTFZEJDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2S/c1-10-7-4-6(5-8)2-3-9-7/h2-4H,5,8H2,1H3.
What are the key properties of (2-methylsulfanyl-4-pyridinyl)methanamine?
(2-methylsulfanyl-4-pyridinyl)methanamine has a molecular weight of 154.24 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylsulfanyl-4-pyridinyl)methanamine is sourced from PubChem (CID 61023047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).