N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine

C14H16N2O2S — CID 1488750

IUPACN,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine
SMILESCNc1nc(-c2ccccc2)cc(C)c1S(C)(=O)=O
InChIInChI=1S/C14H16N2O2S/c1-10-9-12(11-7-5-4-6-8-11)16-14(15-2)13(10)19(3,17)18/h4-9H,1-3H3,(H,15,16)
InChIKeyPMOYDVRHRMHUST-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.50
Rot. Bonds3

About N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine

N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine (PubChem CID 1488750) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine
PubChem CID1488750
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine
SMILESCNc1nc(-c2ccccc2)cc(C)c1S(C)(=O)=O
InChIInChI=1S/C14H16N2O2S/c1-10-9-12(11-7-5-4-6-8-11)16-14(15-2)13(10)19(3,17)18/h4-9H,1-3H3,(H,15,16)
InChIKeyPMOYDVRHRMHUST-UHFFFAOYSA-N
XLogP2.50
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-tert-butyl-N-(6-methylpyridin-2-yl)benzenesulfonamide
CID 815224
2,4-Diaminopyrimidine-based antagonist, 4c
CID 11538533
2,4-Diaminopyrimidine derivative, 11c
CID 11538534
3-(6-Methyl-3-pyridyl)-5-(4-methylsulfonylphenyl)pyridin-2-amine
CID 53311392
N-sec-butyl-4-(4-(methylsulfonyl)phenyl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 45268661
N-(4,6-dimethyl-2-pyridinyl)-4-(2-methylpropyl)benzenesulfonamide
CID 778279
N-(6-Methyl-pyridin-2-yl)-2-(toluene-4-sulfonyl)-acetamide
CID 3163423
N-mesityl-6-methyl-3-tosylpyridin-2-amine
CID 11245983
3-(4-ethylphenylsulfonyl)-N-mesityl-6-methylpyridin-2-amine
CID 11418006
5-(4-(4-(Methylsulfonyl)benzylamino)phenyl)-6-hexylpyrimidine-2,4-diamine
CID 44409809
5-(4-(4-(methylsulfonyl)benzylamino)phenyl)-6-ethyl-N4-methylpyrimidine-2,4-diamine
CID 44409975
4-(3-(Methylsulfonyl)phenyl)-6-propylpyrimidine-2-carbonitrile
CID 46881450

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine?
The IUPAC name of N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine (CID 1488750) is N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine.
What is the SMILES notation for N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine?
The canonical SMILES for N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine is CNc1nc(-c2ccccc2)cc(C)c1S(C)(=O)=O.
What is the InChIKey of N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine?
The InChIKey is PMOYDVRHRMHUST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-10-9-12(11-7-5-4-6-8-11)16-14(15-2)13(10)19(3,17)18/h4-9H,1-3H3,(H,15,16).
What are the key properties of N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine?
N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine has a molecular weight of 276.36 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-3-methylsulfonyl-6-phenylpyridin-2-amine is sourced from PubChem (CID 1488750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).