2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine

C16H25N3O3S — CID 124978136

IUPAC2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine
SMILESCNc1cc(C)nc([C@H]2CN(S(=O)(=O)C3CCCC3)CCO2)c1
InChIInChI=1S/C16H25N3O3S/c1-12-9-13(17-2)10-15(18-12)16-11-19(7-8-22-16)23(20,21)14-5-3-4-6-14/h9-10,14,16H,3-8,11H2,1-2H3,(H,17,18)/t16-/m1/s1
InChIKeyLRPLUXCLCSHBMS-MRXNPFEDSA-N
MW339.46 g/mol
LogP2.08
Rot. Bonds4

About 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine

2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine (PubChem CID 124978136) has the molecular formula C16H25N3O3S and a molecular weight of 339.46 g/mol. Its IUPAC name is 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine.

Molecular Properties

Compound Name2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine
PubChem CID124978136
Molecular FormulaC16H25N3O3S
Molecular Weight339.46 g/mol
Exact Mass339.16
IUPAC Name2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine
SMILESCNc1cc(C)nc([C@H]2CN(S(=O)(=O)C3CCCC3)CCO2)c1
InChIInChI=1S/C16H25N3O3S/c1-12-9-13(17-2)10-15(18-12)16-11-19(7-8-22-16)23(20,21)14-5-3-4-6-14/h9-10,14,16H,3-8,11H2,1-2H3,(H,17,18)/t16-/m1/s1
InChIKeyLRPLUXCLCSHBMS-MRXNPFEDSA-N
XLogP2.08
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.46
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-4-cyclopentylsulfonyl-2-(4,6-dimethylpyrimidin-2-yl)morpholine
CID 125011329
2-[(2S)-4-cyclohexylsulfonylmorpholin-2-yl]-4-methyl-1H-pyrimidin-6-one
CID 137052887
4,6-dimethyl-N-[2-methyl-6-[(2R)-4-pyrrolidin-1-ylsulfonylmorpholin-2-yl]-4-pyridinyl]pyrimidin-2-amine
CID 125025381
6-[(2S)-4-cyclopentylsulfonylmorpholin-2-yl]-N-(1,5-dimethylpyrazol-3-yl)pyridin-2-amine
CID 124970812
(2-fluorophenyl)-[(2S)-2-[6-methyl-4-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 125015560
2-cyclopentyl-N,6-dimethylpyridin-4-amine;dihydrochloride
CID 172850229
(E)-1-[(2R)-2-[6-methyl-4-(methylamino)-2-pyridinyl]morpholin-4-yl]-3-phenylprop-2-en-1-one
CID 124951344
2H-benzotriazol-5-yl-[2-[6-methyl-4-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 155901308
2-(2,6-dimethylpyrimidin-4-yl)-N,N-dimethylmorpholine-4-sulfonamide
CID 110115941
1-[(2S)-2-[6-methyl-4-(methylamino)-2-pyridinyl]morpholin-4-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone
CID 124990126
1H-indol-2-yl-[2-[6-methyl-4-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 110113526
(1-ethylpyrazol-4-yl)-[2-[6-methyl-4-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 110113502

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine?
The IUPAC name of 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine (CID 124978136) is 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine.
What is the SMILES notation for 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine?
The canonical SMILES for 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine is CNc1cc(C)nc([C@H]2CN(S(=O)(=O)C3CCCC3)CCO2)c1.
What is the InChIKey of 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine?
The InChIKey is LRPLUXCLCSHBMS-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H25N3O3S/c1-12-9-13(17-2)10-15(18-12)16-11-19(7-8-22-16)23(20,21)14-5-3-4-6-14/h9-10,14,16H,3-8,11H2,1-2H3,(H,17,18)/t16-/m1/s1.
What are the key properties of 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine?
2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine has a molecular weight of 339.46 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-4-cyclopentylsulfonylmorpholin-2-yl]-N,6-dimethylpyridin-4-amine is sourced from PubChem (CID 124978136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).