1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone

C17H25N3O2 — CID 124970514

IUPAC1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone
SMILESNc1cccc([C@@H]2CN(C(=O)CC3CCCCC3)CCO2)n1
InChIInChI=1S/C17H25N3O2/c18-16-8-4-7-14(19-16)15-12-20(9-10-22-15)17(21)11-13-5-2-1-3-6-13/h4,7-8,13,15H,1-3,5-6,9-12H2,(H2,18,19)/t15-/m0/s1
InChIKeyJQOAIHBEAHCQOF-HNNXBMFYSA-N
MW303.41 g/mol
LogP2.53
Rot. Bonds3

About 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone

1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone (PubChem CID 124970514) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone.

Molecular Properties

Compound Name1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone
PubChem CID124970514
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone
SMILESNc1cccc([C@@H]2CN(C(=O)CC3CCCCC3)CCO2)n1
InChIInChI=1S/C17H25N3O2/c18-16-8-4-7-14(19-16)15-12-20(9-10-22-15)17(21)11-13-5-2-1-3-6-13/h4,7-8,13,15H,1-3,5-6,9-12H2,(H2,18,19)/t15-/m0/s1
InChIKeyJQOAIHBEAHCQOF-HNNXBMFYSA-N
XLogP2.53
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-(1-hydroxycyclohexyl)ethanone
CID 124943141
1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-(4-methoxyphenoxy)ethanone
CID 110112348
2-cyclopentyl-1-(2-pyrazin-2-ylmorpholin-4-yl)ethanone
CID 127246236
1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-(5-methylthiophen-2-yl)ethanone
CID 110112351
2-cyclohexyl-1-[2-(4-methylphenyl)morpholin-4-yl]ethanone
CID 121134744
1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-(2-methylbenzimidazol-1-yl)ethanone
CID 125019995
2-cyclopentyl-1-[2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]ethanone
CID 110112937
2-cyclopentyl-1-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]ethanone
CID 94823425
tert-butyl (2S)-2-(6-amino-2-pyridinyl)morpholine-4-carboxylate
CID 129322939
[(2R)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-(2-methylpyrimidin-4-yl)methanone
CID 125016179
2-cyclopentyl-1-[(2S)-2-(2-methyl-4-pyridinyl)morpholin-4-yl]ethanone
CID 124987741
[(2R)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-(5-ethyl-1,2-oxazol-3-yl)methanone
CID 124988458

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone?
The IUPAC name of 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone (CID 124970514) is 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone.
What is the SMILES notation for 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone?
The canonical SMILES for 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone is Nc1cccc([C@@H]2CN(C(=O)CC3CCCCC3)CCO2)n1.
What is the InChIKey of 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone?
The InChIKey is JQOAIHBEAHCQOF-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H25N3O2/c18-16-8-4-7-14(19-16)15-12-20(9-10-22-15)17(21)11-13-5-2-1-3-6-13/h4,7-8,13,15H,1-3,5-6,9-12H2,(H2,18,19)/t15-/m0/s1.
What are the key properties of 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone?
1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone has a molecular weight of 303.41 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-cyclohexylethanone is sourced from PubChem (CID 124970514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).