6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine

C10H16N2OS — CID 63965720

IUPAC6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine
SMILESCOc1cccc(NCCCSC)n1
InChIInChI=1S/C10H16N2OS/c1-13-10-6-3-5-9(12-10)11-7-4-8-14-2/h3,5-6H,4,7-8H2,1-2H3,(H,11,12)
InChIKeyGIVQRNPFCLHSRK-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.26
Rot. Bonds6

About 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine

6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine (PubChem CID 63965720) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine
PubChem CID63965720
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine
SMILESCOc1cccc(NCCCSC)n1
InChIInChI=1S/C10H16N2OS/c1-13-10-6-3-5-9(12-10)11-7-4-8-14-2/h3,5-6H,4,7-8H2,1-2H3,(H,11,12)
InChIKeyGIVQRNPFCLHSRK-UHFFFAOYSA-N
XLogP2.26
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-methoxy-N-(2-methylsulfanylethyl)pyridin-2-amine
CID 63965022
6-[(6-methoxy-2-pyridinyl)amino]hexan-1-ol
CID 107848852
6-methoxy-N-(3-methylsulfonylpropyl)pyridin-2-amine
CID 63591649
2-[3-[(6-methoxy-2-pyridinyl)amino]propoxy]ethanol
CID 106307016
6-methoxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 104762395
N-(6-methoxy-2-pyridinyl)-N'-methyl-N'-phenylpropane-1,3-diamine
CID 63591094
N-(6-methoxy-2-pyridinyl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 63590212
6-methoxy-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine
CID 63589886
4-methoxy-N-(4-methylsulfanylbutyl)pyrimidin-2-amine
CID 115637365
6-methoxy-N-[2-(2-methylphenyl)ethyl]pyridin-2-amine
CID 79756545
6-methoxy-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridin-2-amine
CID 55259536
3-[(6-methoxy-2-pyridinyl)amino]-N,N-dimethylpropanamide
CID 63590933

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine?
The IUPAC name of 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine (CID 63965720) is 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine.
What is the SMILES notation for 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine?
The canonical SMILES for 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine is COc1cccc(NCCCSC)n1.
What is the InChIKey of 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine?
The InChIKey is GIVQRNPFCLHSRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-13-10-6-3-5-9(12-10)11-7-4-8-14-2/h3,5-6H,4,7-8H2,1-2H3,(H,11,12).
What are the key properties of 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine?
6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine has a molecular weight of 212.32 g/mol, XLogP of 2.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(3-methylsulfanylpropyl)pyridin-2-amine is sourced from PubChem (CID 63965720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).