2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine

C14H16N2OS — CID 55112968

IUPAC2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine
SMILESCOc1nc(SCc2ccccc2C)ccc1N
InChIInChI=1S/C14H16N2OS/c1-10-5-3-4-6-11(10)9-18-13-8-7-12(15)14(16-13)17-2/h3-8H,9,15H2,1-2H3
InChIKeyMUZMPMBQEAYFRT-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.27
Rot. Bonds4

About 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine

2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine (PubChem CID 55112968) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine.

Molecular Properties

Compound Name2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine
PubChem CID55112968
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine
SMILESCOc1nc(SCc2ccccc2C)ccc1N
InChIInChI=1S/C14H16N2OS/c1-10-5-3-4-6-11(10)9-18-13-8-7-12(15)14(16-13)17-2/h3-8H,9,15H2,1-2H3
InChIKeyMUZMPMBQEAYFRT-UHFFFAOYSA-N
XLogP3.27
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(5-amino-6-methoxy-2-pyridinyl)sulfanyl]-2-methylpropan-1-ol
CID 66105506
5-methyl-2-[(2-methylphenyl)methylsulfanyl]pyridin-4-amine
CID 83267578
2-methyl-4-[(2-methylphenyl)methylsulfanyl]aniline
CID 62771925
6-[(2-methylphenyl)methylsulfanyl]-4-(trifluoromethyl)pyridin-2-amine
CID 102720333
6-(3,4-dimethylphenyl)sulfanyl-2-methoxypyridin-3-amine
CID 43262776
5-amino-6-[(2-methylphenyl)methylsulfanyl]pyridine-2-carboxylic acid
CID 114409611
3-[(2-methylphenyl)methylsulfanyl]quinoxalin-2-amine
CID 102988934
2-fluoro-4-[(2-methylphenyl)methylsulfanyl]aniline
CID 79141636
2-[(2-methylphenyl)methylsulfanylmethyl]aniline
CID 62055179
methyl 6-[(2-methylphenyl)methylsulfanyl]pyrazine-2-carboxylate
CID 66449412
2-methoxy-6-(4-propan-2-ylphenyl)sulfanylpyridin-3-amine
CID 43262707
6-(2-methylphenyl)sulfanyl-2-propoxypyridin-3-amine
CID 63537893

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine?
The IUPAC name of 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine (CID 55112968) is 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine.
What is the SMILES notation for 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine?
The canonical SMILES for 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine is COc1nc(SCc2ccccc2C)ccc1N.
What is the InChIKey of 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine?
The InChIKey is MUZMPMBQEAYFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-10-5-3-4-6-11(10)9-18-13-8-7-12(15)14(16-13)17-2/h3-8H,9,15H2,1-2H3.
What are the key properties of 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine?
2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine has a molecular weight of 260.36 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[(2-methylphenyl)methylsulfanyl]pyridin-3-amine is sourced from PubChem (CID 55112968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).