[2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine

C13H14N2OS — CID 61289802

IUPAC[2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine
SMILESCOc1ccccc1Sc1cc(CN)ccn1
InChIInChI=1S/C13H14N2OS/c1-16-11-4-2-3-5-12(11)17-13-8-10(9-14)6-7-15-13/h2-8H,9,14H2,1H3
InChIKeyNWNVTZURRWDVCM-UHFFFAOYSA-N
MW246.34 g/mol
LogP2.70
Rot. Bonds4

About [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine

[2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine (PubChem CID 61289802) has the molecular formula C13H14N2OS and a molecular weight of 246.34 g/mol. Its IUPAC name is [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine
PubChem CID61289802
Molecular FormulaC13H14N2OS
Molecular Weight246.34 g/mol
Exact Mass246.08
IUPAC Name[2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine
SMILESCOc1ccccc1Sc1cc(CN)ccn1
InChIInChI=1S/C13H14N2OS/c1-16-11-4-2-3-5-12(11)17-13-8-10(9-14)6-7-15-13/h2-8H,9,14H2,1H3
InChIKeyNWNVTZURRWDVCM-UHFFFAOYSA-N
XLogP2.70
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[6-(2-methoxyphenyl)sulfanyl-3-pyridinyl]methanamine
CID 61289983
4-fluoro-6-(2-methoxyphenyl)sulfanylpyrimidine
CID 115417343
[3-fluoro-4-[(2-methoxyphenyl)sulfanylmethyl]phenyl]methanamine
CID 61291113
[4-[2-(2-methoxyphenyl)sulfanylethoxy]phenyl]methanamine
CID 61291497
[2-(2-propan-2-ylphenoxy)-4-pyridinyl]methanamine
CID 16795671
[3-(2-methoxyphenyl)sulfanylpyridazin-4-yl]methanamine
CID 80514839
(3-methyl-4-pyridin-2-ylsulfanylphenyl)methanamine
CID 60930294
2-chloro-6-(2-methoxyphenyl)sulfanylpyridin-4-amine
CID 114070766
[4-(2-methoxyphenyl)sulfanylquinolin-3-yl]methanamine
CID 61290357
[4-methoxy-3-[2-(2-methoxyphenoxy)ethoxy]phenyl]methanamine
CID 20992369
1-methoxy-2-[(E)-4-(2-methoxyphenyl)sulfanylbut-2-enyl]sulfanylbenzene
CID 60593855
6-(2-methoxyphenyl)sulfanyl-2-propoxypyridin-3-amine
CID 61296899

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine?
The IUPAC name of [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine (CID 61289802) is [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine?
The canonical SMILES for [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine is COc1ccccc1Sc1cc(CN)ccn1.
What is the InChIKey of [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine?
The InChIKey is NWNVTZURRWDVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2OS/c1-16-11-4-2-3-5-12(11)17-13-8-10(9-14)6-7-15-13/h2-8H,9,14H2,1H3.
What are the key properties of [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine?
[2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine has a molecular weight of 246.34 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyphenyl)sulfanyl-4-pyridinyl]methanamine is sourced from PubChem (CID 61289802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).