(1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone

C12H22N2O3 — CID 125119390

IUPAC(1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone
SMILESCOC[C@@H]1CN(C(=O)C2(N)CCCC2)CCO1
InChIInChI=1S/C12H22N2O3/c1-16-9-10-8-14(6-7-17-10)11(15)12(13)4-2-3-5-12/h10H,2-9,13H2,1H3/t10-/m0/s1
InChIKeyWOTDLRHPULOJTR-JTQLQIEISA-N
MW242.32 g/mol
LogP0.13
Rot. Bonds3

About (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone

(1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone (PubChem CID 125119390) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone
PubChem CID125119390
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name(1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone
SMILESCOC[C@@H]1CN(C(=O)C2(N)CCCC2)CCO1
InChIInChI=1S/C12H22N2O3/c1-16-9-10-8-14(6-7-17-10)11(15)12(13)4-2-3-5-12/h10H,2-9,13H2,1H3/t10-/m0/s1
InChIKeyWOTDLRHPULOJTR-JTQLQIEISA-N
XLogP0.13
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-aminocyclopropyl)-[2-(methoxymethyl)morpholin-4-yl]methanone
CID 119793003
(1-aminocyclohexyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone;hydrochloride
CID 119322376
(1-aminocyclopropyl)-(2-ethylmorpholin-4-yl)methanone
CID 65466783
(1-aminocyclopentyl)-(2-methylmorpholin-4-yl)methanone
CID 60867018
(1-aminocyclobutyl)-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 106586736
4-amino-1-[2-(methoxymethyl)morpholin-4-yl]pentan-1-one;hydrochloride
CID 120562971
(2S)-2-amino-1-[(2S)-2-(methoxymethyl)morpholin-4-yl]-4-methylpentan-1-one
CID 124721809
(1-aminocyclopentyl)-[3-(2-methoxyethoxymethyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 119338489
2-(8-azabicyclo[3.2.1]octan-3-yl)-1-[2-(methoxymethyl)morpholin-4-yl]ethanone
CID 119793029
2-[2-(methoxymethyl)morpholine-4-carbonyl]cyclobutane-1-carboxylic acid
CID 120976260
[2-(methoxymethyl)morpholin-4-yl]-(4-pyrazol-1-ylpiperidin-4-yl)methanone;hydrochloride
CID 120933760
1-[4-(1-aminocyclopentanecarbonyl)piperazin-1-yl]-2-methoxyethanone
CID 54872234

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone?
The IUPAC name of (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone (CID 125119390) is (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone.
What is the SMILES notation for (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone?
The canonical SMILES for (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone is COC[C@@H]1CN(C(=O)C2(N)CCCC2)CCO1.
What is the InChIKey of (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone?
The InChIKey is WOTDLRHPULOJTR-JTQLQIEISA-N. The full InChI is InChI=1S/C12H22N2O3/c1-16-9-10-8-14(6-7-17-10)11(15)12(13)4-2-3-5-12/h10H,2-9,13H2,1H3/t10-/m0/s1.
What are the key properties of (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone?
(1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone has a molecular weight of 242.32 g/mol, XLogP of 0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopentyl)-[(2S)-2-(methoxymethyl)morpholin-4-yl]methanone is sourced from PubChem (CID 125119390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).