6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine

C15H24N4O2S — CID 124983194

IUPAC6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine
SMILESCc1nc(N)cc([C@H]2CCCN2S(=O)(=O)C2CCCCC2)n1
InChIInChI=1S/C15H24N4O2S/c1-11-17-13(10-15(16)18-11)14-8-5-9-19(14)22(20,21)12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3,(H2,16,17,18)/t14-/m1/s1
InChIKeyNCEJHKARYYHIEM-CQSZACIVSA-N
MW324.45 g/mol
LogP2.17
Rot. Bonds3

About 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine

6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine (PubChem CID 124983194) has the molecular formula C15H24N4O2S and a molecular weight of 324.45 g/mol. Its IUPAC name is 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine
PubChem CID124983194
Molecular FormulaC15H24N4O2S
Molecular Weight324.45 g/mol
Exact Mass324.16
IUPAC Name6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine
SMILESCc1nc(N)cc([C@H]2CCCN2S(=O)(=O)C2CCCCC2)n1
InChIInChI=1S/C15H24N4O2S/c1-11-17-13(10-15(16)18-11)14-8-5-9-19(14)22(20,21)12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3,(H2,16,17,18)/t14-/m1/s1
InChIKeyNCEJHKARYYHIEM-CQSZACIVSA-N
XLogP2.17
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[1-(benzenesulfonyl)pyrrolidin-2-yl]-2-methylpyrimidin-4-amine
CID 110091079
2-methyl-6-[1-(1-methylsulfonylpiperidin-4-yl)pyrrolidin-2-yl]pyrimidin-4-amine
CID 110091082
6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine
CID 110271708
2-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]pyrazine
CID 124955860
2-[(2S)-1-cyclopentylsulfonylpyrrolidin-2-yl]pyrazine
CID 125001478
1-[4-[(2R)-1-cyclopentylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-5-yl]-N,N-dimethylmethanamine
CID 124958910
[(2S)-2-(6-amino-2-methylpyrimidin-4-yl)pyrrolidin-1-yl]-(4-methyl-1,3-oxazol-5-yl)methanone
CID 124993727
4-methyl-2-[2-methyl-6-(1-methylsulfonylpiperidin-2-yl)pyrimidin-4-yl]-1,3-thiazole
CID 110100445
2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-6-(1-methylsulfonylpyrrolidin-2-yl)pyrimidin-4-amine
CID 110255470
6-[1-(benzenesulfonyl)pyrrolidin-2-yl]-N,2-dimethylpyrimidin-4-amine
CID 110113647
N,2-dimethyl-6-(1-morpholin-4-ylsulfonylpyrrolidin-2-yl)pyrimidin-4-amine
CID 110113612
6-[(2S)-1-(4-fluorophenyl)sulfonylpyrrolidin-2-yl]-N,2-dimethylpyrimidin-4-amine
CID 125000616

Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine?
The IUPAC name of 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine (CID 124983194) is 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine.
What is the SMILES notation for 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine?
The canonical SMILES for 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine is Cc1nc(N)cc([C@H]2CCCN2S(=O)(=O)C2CCCCC2)n1.
What is the InChIKey of 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine?
The InChIKey is NCEJHKARYYHIEM-CQSZACIVSA-N. The full InChI is InChI=1S/C15H24N4O2S/c1-11-17-13(10-15(16)18-11)14-8-5-9-19(14)22(20,21)12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3,(H2,16,17,18)/t14-/m1/s1.
What are the key properties of 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine?
6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine has a molecular weight of 324.45 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine is sourced from PubChem (CID 124983194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).