6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine

C14H17N3O3S — CID 43261499

IUPAC6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine
SMILESCCOc1nc(Nc2ccc(S(C)(=O)=O)cc2)ccc1N
InChIInChI=1S/C14H17N3O3S/c1-3-20-14-12(15)8-9-13(17-14)16-10-4-6-11(7-5-10)21(2,18)19/h4-9H,3,15H2,1-2H3,(H,16,17)
InChIKeyODTAVSHIYQGYKG-UHFFFAOYSA-N
MW307.38 g/mol
LogP2.21
Rot. Bonds5

About 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine

6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine (PubChem CID 43261499) has the molecular formula C14H17N3O3S and a molecular weight of 307.38 g/mol. Its IUPAC name is 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine
PubChem CID43261499
Molecular FormulaC14H17N3O3S
Molecular Weight307.38 g/mol
Exact Mass307.10
IUPAC Name6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine
SMILESCCOc1nc(Nc2ccc(S(C)(=O)=O)cc2)ccc1N
InChIInChI=1S/C14H17N3O3S/c1-3-20-14-12(15)8-9-13(17-14)16-10-4-6-11(7-5-10)21(2,18)19/h4-9H,3,15H2,1-2H3,(H,16,17)
InChIKeyODTAVSHIYQGYKG-UHFFFAOYSA-N
XLogP2.21
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-ethoxy-2-N-phenylpyridine-2,5-diamine
CID 43261284
2-N-(4-butylphenyl)-6-ethoxypyridine-2,5-diamine
CID 43378425
6-ethoxy-2-N-(4-propan-2-yloxyphenyl)pyridine-2,5-diamine
CID 43261775
6-ethoxy-2-N-(4-fluoro-3-methylphenyl)pyridine-2,5-diamine
CID 55118976
2-N-[3-(dimethylamino)-4-methylphenyl]-6-ethoxypyridine-2,5-diamine
CID 115376297
2-[(5-amino-6-ethoxy-2-pyridinyl)amino]ethanesulfonamide
CID 43551624
2-N-ethyl-6-N-(4-methylsulfonylphenyl)pyridine-2,6-diamine
CID 80762611
2-N-(4-ethylphenyl)-6-methoxypyridine-2,5-diamine
CID 43261633
6-ethoxy-2-N-(1-ethylpyrazol-3-yl)pyridine-2,5-diamine
CID 114251452
2-[4-[(5-amino-6-propoxy-2-pyridinyl)amino]phenyl]acetonitrile
CID 62301180
2-amino-5-(4-methylsulfonylanilino)benzoic acid
CID 60989498
6-ethoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine
CID 43261092

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine?
The IUPAC name of 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine (CID 43261499) is 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine.
What is the SMILES notation for 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine?
The canonical SMILES for 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine is CCOc1nc(Nc2ccc(S(C)(=O)=O)cc2)ccc1N.
What is the InChIKey of 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine?
The InChIKey is ODTAVSHIYQGYKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S/c1-3-20-14-12(15)8-9-13(17-14)16-10-4-6-11(7-5-10)21(2,18)19/h4-9H,3,15H2,1-2H3,(H,16,17).
What are the key properties of 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine?
6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine has a molecular weight of 307.38 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-N-(4-methylsulfonylphenyl)pyridine-2,5-diamine is sourced from PubChem (CID 43261499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).