N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine

C14H16N2O3S — CID 62193963

IUPACN-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine
SMILESCNc1ccc(COc2ccc(S(C)(=O)=O)cc2)cn1
InChIInChI=1S/C14H16N2O3S/c1-15-14-8-3-11(9-16-14)10-19-12-4-6-13(7-5-12)20(2,17)18/h3-9H,10H2,1-2H3,(H,15,16)
InChIKeyCQHPBUDXWKPMHV-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.11
Rot. Bonds5

About N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine

N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine (PubChem CID 62193963) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine
PubChem CID62193963
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine
SMILESCNc1ccc(COc2ccc(S(C)(=O)=O)cc2)cn1
InChIInChI=1S/C14H16N2O3S/c1-15-14-8-3-11(9-16-14)10-19-12-4-6-13(7-5-12)20(2,17)18/h3-9H,10H2,1-2H3,(H,15,16)
InChIKeyCQHPBUDXWKPMHV-UHFFFAOYSA-N
XLogP2.11
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(4-methoxy-3-nitrophenoxy)methyl]-N-methylpyridin-2-amine
CID 103202259
1,3-dimethyl-5-[(4-methylsulfonylphenoxy)methyl]benzene
CID 23017924
5-[(2,6-dimethylphenoxy)methyl]-N-methylpyridin-2-amine
CID 62195101
5-[(4-methylsulfonylphenoxy)methyl]pyrazin-2-amine
CID 103058824
N-ethyl-5-[(4-ethylphenoxy)methyl]pyridin-2-amine
CID 55044783
5-[(2-fluoro-6-nitrophenoxy)methyl]-N-methylpyridin-2-amine
CID 104832417
5-[[3-(dimethylamino)phenoxy]methyl]-N-methylpyridin-2-amine
CID 62187826
N-ethyl-5-[(4-propylphenoxy)methyl]pyridin-2-amine
CID 62548057
N-methyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
CID 55045216
N-[[5-[(4-methylsulfonylphenyl)methoxy]-2-pyridinyl]methylidene]hydroxylamine
CID 137199426
4-[(2-tert-butylpyrimidin-5-yl)methoxy]-N-methylbenzenesulfonamide
CID 166287676
5-[(4-ethylphenoxy)methyl]-N-propylpyridin-2-amine
CID 62194753

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine?
The IUPAC name of N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine (CID 62193963) is N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine is CNc1ccc(COc2ccc(S(C)(=O)=O)cc2)cn1.
What is the InChIKey of N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine?
The InChIKey is CQHPBUDXWKPMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-15-14-8-3-11(9-16-14)10-19-12-4-6-13(7-5-12)20(2,17)18/h3-9H,10H2,1-2H3,(H,15,16).
What are the key properties of N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine?
N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine has a molecular weight of 292.36 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 62193963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).