(2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone

C17H24FN3O2 — CID 124593426

IUPAC(2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone
SMILESN[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2F)N2CCOCC2)C1
InChIInChI=1S/C17H24FN3O2/c18-15-6-2-1-5-14(15)16(20-8-10-23-11-9-20)17(22)21-7-3-4-13(19)12-21/h1-2,5-6,13,16H,3-4,7-12,19H2/t13-,16-/m1/s1
InChIKeyFFGKWUIFNXIIGP-CZUORRHYSA-N
MW321.40 g/mol
LogP1.15
Rot. Bonds3

About (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone

(2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone (PubChem CID 124593426) has the molecular formula C17H24FN3O2 and a molecular weight of 321.40 g/mol. Its IUPAC name is (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone.

Molecular Properties

Compound Name(2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone
PubChem CID124593426
Molecular FormulaC17H24FN3O2
Molecular Weight321.40 g/mol
Exact Mass321.19
IUPAC Name(2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone
SMILESN[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2F)N2CCOCC2)C1
InChIInChI=1S/C17H24FN3O2/c18-15-6-2-1-5-14(15)16(20-8-10-23-11-9-20)17(22)21-7-3-4-13(19)12-21/h1-2,5-6,13,16H,3-4,7-12,19H2/t13-,16-/m1/s1
InChIKeyFFGKWUIFNXIIGP-CZUORRHYSA-N
XLogP1.15
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone with MolForge

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Related Compounds

(2R)-2-(2-fluorophenyl)-1-[(3S)-3-(methylaminomethyl)pyrrolidin-1-yl]-2-morpholin-4-ylethanone
CID 124612695
(2S)-2-(2-fluorophenyl)-1-[(3R)-3-methylpiperazin-1-yl]-2-morpholin-4-ylethanone
CID 124591150
(2R)-2-(2-fluorophenyl)-1-[(3S)-3-methylpiperazin-1-yl]-2-morpholin-4-ylethanone
CID 124591149
1-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone
CID 120746023
1-(4-amino-3,3-dimethylpiperidin-1-yl)-2-(2-fluorophenyl)-2-morpholin-4-ylethanone;dihydrochloride
CID 120813896
[(3R)-3-aminopiperidin-1-yl]-(2,6-difluorophenyl)methanone
CID 102978457
2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
CID 119460909
(2S)-1-[(3S)-3-aminopiperidin-1-yl]-2-methyl-3-phenylsulfanylpropan-1-one
CID 124594002
(3-aminoazepan-1-yl)-(2-morpholin-4-ylphenyl)methanone
CID 70747258
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
CID 71871802
1-(3-aminopiperidin-1-yl)-2-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one
CID 119380573
2-(3-aminopiperidine-1-carbonyl)benzoic acid
CID 61403703

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone?
The IUPAC name of (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone (CID 124593426) is (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone.
What is the SMILES notation for (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone?
The canonical SMILES for (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone is N[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2F)N2CCOCC2)C1.
What is the InChIKey of (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone?
The InChIKey is FFGKWUIFNXIIGP-CZUORRHYSA-N. The full InChI is InChI=1S/C17H24FN3O2/c18-15-6-2-1-5-14(15)16(20-8-10-23-11-9-20)17(22)21-7-3-4-13(19)12-21/h1-2,5-6,13,16H,3-4,7-12,19H2/t13-,16-/m1/s1.
What are the key properties of (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone?
(2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone has a molecular weight of 321.40 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(3R)-3-aminopiperidin-1-yl]-2-(2-fluorophenyl)-2-morpholin-4-ylethanone is sourced from PubChem (CID 124593426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).