5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine

C9H10N4O2S — CID 84727720

IUPAC5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine
SMILESCc1cc(N)nc2nc(S(C)(=O)=O)ncc12
InChIInChI=1S/C9H10N4O2S/c1-5-3-7(10)12-8-6(5)4-11-9(13-8)16(2,14)15/h3-4H,1-2H3,(H2,10,11,12,13)
InChIKeyQMGIOVTYJTZRQN-UHFFFAOYSA-N
MW238.27 g/mol
LogP0.32
Rot. Bonds1

About 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine

5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine (PubChem CID 84727720) has the molecular formula C9H10N4O2S and a molecular weight of 238.27 g/mol. Its IUPAC name is 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine.

Molecular Properties

Compound Name5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine
PubChem CID84727720
Molecular FormulaC9H10N4O2S
Molecular Weight238.27 g/mol
Exact Mass238.05
IUPAC Name5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine
SMILESCc1cc(N)nc2nc(S(C)(=O)=O)ncc12
InChIInChI=1S/C9H10N4O2S/c1-5-3-7(10)12-8-6(5)4-11-9(13-8)16(2,14)15/h3-4H,1-2H3,(H2,10,11,12,13)
InChIKeyQMGIOVTYJTZRQN-UHFFFAOYSA-N
XLogP0.32
TPSA98.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.27
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-2-methylsulfonylpyrimidine-4-carboxamide
CID 147689446
4-methyl-1,8-naphthyridin-2-amine
CID 23008692
ethane;5-methyl-2-methylsulfonylpyrimidine
CID 176693860
6-(aminomethyl)-2-methylsulfonylpyrimidin-4-amine
CID 83852131
ethyl 5-methyl-2-methylsulfonylpyrimidine-4-carboxylate
CID 167884840
(4-methyl-2-methylsulfonylpyrimidin-5-yl)methanol
CID 84721428
3-bromo-1-methyl-6-methylsulfonylpyrazolo[3,4-d]pyrimidine;3-bromo-1-methylpyrazolo[3,4-d]pyrimidin-6-amine
CID 157473843
2-methylsulfonyl-6-pyridin-4-ylpyrimidin-4-amine
CID 69280571
(5-bromo-2-methylsulfonylpyrimidin-4-yl)hydrazine
CID 163304288
3,4-dimethylpyridine-2,6-diamine
CID 23049439
4-chloro-2-methylsulfonylpyrimidine;4-chloropyrimidin-2-amine
CID 159327142
2-methylsulfonylpyrimidine-5-thiol
CID 75480815

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine?
The IUPAC name of 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine (CID 84727720) is 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine.
What is the SMILES notation for 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine?
The canonical SMILES for 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine is Cc1cc(N)nc2nc(S(C)(=O)=O)ncc12.
What is the InChIKey of 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine?
The InChIKey is QMGIOVTYJTZRQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2S/c1-5-3-7(10)12-8-6(5)4-11-9(13-8)16(2,14)15/h3-4H,1-2H3,(H2,10,11,12,13).
What are the key properties of 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine?
5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine has a molecular weight of 238.27 g/mol, XLogP of 0.32, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-methylsulfonylpyrido[2,3-d]pyrimidin-7-amine is sourced from PubChem (CID 84727720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).