N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine

C7H10N2S — CID 143294917

IUPACN-[(2-methyl-3-pyridinyl)sulfanyl]methanamine
SMILESCNSc1cccnc1C
InChIInChI=1S/C7H10N2S/c1-6-7(10-8-2)4-3-5-9-6/h3-5,8H,1-2H3
InChIKeyHCJULZPEHZMKFR-UHFFFAOYSA-N
MW154.24 g/mol
LogP1.62
Rot. Bonds2

About N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine

N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine (PubChem CID 143294917) has the molecular formula C7H10N2S and a molecular weight of 154.24 g/mol. Its IUPAC name is N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine.

Molecular Properties

Compound NameN-[(2-methyl-3-pyridinyl)sulfanyl]methanamine
PubChem CID143294917
Molecular FormulaC7H10N2S
Molecular Weight154.24 g/mol
Exact Mass154.06
IUPAC NameN-[(2-methyl-3-pyridinyl)sulfanyl]methanamine
SMILESCNSc1cccnc1C
InChIInChI=1S/C7H10N2S/c1-6-7(10-8-2)4-3-5-9-6/h3-5,8H,1-2H3
InChIKeyHCJULZPEHZMKFR-UHFFFAOYSA-N
XLogP1.62
TPSA24.92 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 ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-methyl-3-methylsulfanylpyridine;propane
CID 142465096
ethane;3-ethylsulfanyl-2-methylpyridine
CID 142913740
2-methyl-3-nitrosulfanylpyridine
CID 141378836
bis(2,3-dimethylpyridine);ethane
CID 159594018
N-(2-bromophenyl)sulfanylmethanamine
CID 123355576
CID 88656864
CID 88656864
ethane;2-methyl-3-propan-2-ylpyridine
CID 142858508
N,4-dimethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
CID 105126712
methyl 2-hydroxy-2-(2-methyl-3-pyridinyl)acetate
CID 57017613
ethane;2-methyl-3-propan-2-ylpyridine;vanadium
CID 143650392
(1S)-1-(2-methyl-3-pyridinyl)ethanamine
CID 94864826
2-methylpyridin-3-amine;hydroiodide
CID 172837374

Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine?
The IUPAC name of N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine (CID 143294917) is N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine.
What is the SMILES notation for N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine?
The canonical SMILES for N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine is CNSc1cccnc1C.
What is the InChIKey of N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine?
The InChIKey is HCJULZPEHZMKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2S/c1-6-7(10-8-2)4-3-5-9-6/h3-5,8H,1-2H3.
What are the key properties of N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine?
N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine has a molecular weight of 154.24 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-3-pyridinyl)sulfanyl]methanamine is sourced from PubChem (CID 143294917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).