[(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone

C13H24N2O2 — CID 124510962

IUPAC[(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone
SMILESC[C@@H]1CN(C(=O)[C@H]2CCC[C@@H]2N)CC(C)(C)O1
InChIInChI=1S/C13H24N2O2/c1-9-7-15(8-13(2,3)17-9)12(16)10-5-4-6-11(10)14/h9-11H,4-8,14H2,1-3H3/t9-,10+,11+/m1/s1
InChIKeyYCFARPGSZKEQMS-VWYCJHECSA-N
MW240.35 g/mol
LogP1.14
Rot. Bonds1

About [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone

[(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone (PubChem CID 124510962) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name[(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone
PubChem CID124510962
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name[(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone
SMILESC[C@@H]1CN(C(=O)[C@H]2CCC[C@@H]2N)CC(C)(C)O1
InChIInChI=1S/C13H24N2O2/c1-9-7-15(8-13(2,3)17-9)12(16)10-5-4-6-11(10)14/h9-11H,4-8,14H2,1-3H3/t9-,10+,11+/m1/s1
InChIKeyYCFARPGSZKEQMS-VWYCJHECSA-N
XLogP1.14
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(1R,2R)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone
CID 124778662
(3-amino-4-methylcyclohexyl)-(2,2,6-trimethylmorpholin-4-yl)methanone
CID 62780960
3-(2,2,6-trimethylmorpholine-4-carbonyl)cyclopentane-1-carboxylic acid
CID 103550624
(2-amino-3-methylcyclohexyl)-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methanone
CID 114780403
(3-amino-2-methylcyclohexyl)-(2,6-dimethylmorpholin-4-yl)methanone
CID 62777748
(2-aminocyclopentyl)-[(3S,4R)-3,4-dihydroxypyrrolidin-1-yl]methanone
CID 107220787
[(2S,5R)-5-(aminomethyl)oxolan-2-yl]-(2,2,6-trimethylmorpholin-4-yl)methanone;hydrochloride
CID 120789745
2-hydroxy-1-(2,2,6-trimethylmorpholin-4-yl)ethanone
CID 131155747
3-bromo-1-(2,2,6-trimethylmorpholin-4-yl)prop-2-yn-1-one
CID 131064900
(1-aminocyclopropyl)-(2,2,6-trimethylmorpholin-4-yl)methanone;hydrochloride
CID 119748927
N,N-dimethyl-4-(2,2,6-trimethylmorpholine-4-carbonyl)piperidine-1-carboxamide
CID 48690060
1-(2,2,6-trimethylmorpholine-4-carbonyl)cyclobutane-1-carboxylic acid
CID 62097167

Frequently Asked Questions

What is the IUPAC name of [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone?
The IUPAC name of [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone (CID 124510962) is [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone.
What is the SMILES notation for [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone?
The canonical SMILES for [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone is C[C@@H]1CN(C(=O)[C@H]2CCC[C@@H]2N)CC(C)(C)O1.
What is the InChIKey of [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone?
The InChIKey is YCFARPGSZKEQMS-VWYCJHECSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-9-7-15(8-13(2,3)17-9)12(16)10-5-4-6-11(10)14/h9-11H,4-8,14H2,1-3H3/t9-,10+,11+/m1/s1.
What are the key properties of [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone?
[(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone has a molecular weight of 240.35 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S)-2-aminocyclopentyl]-[(6R)-2,2,6-trimethylmorpholin-4-yl]methanone is sourced from PubChem (CID 124510962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).