1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol

C14H22N2O3 — CID 43364486

IUPAC1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol
SMILESCC1CN(CC(O)COc2ccccc2N)CCO1
InChIInChI=1S/C14H22N2O3/c1-11-8-16(6-7-18-11)9-12(17)10-19-14-5-3-2-4-13(14)15/h2-5,11-12,17H,6-10,15H2,1H3
InChIKeyMEWCFDHENOKDOC-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.73
Rot. Bonds5

About 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol

1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol (PubChem CID 43364486) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol
PubChem CID43364486
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol
SMILESCC1CN(CC(O)COc2ccccc2N)CCO1
InChIInChI=1S/C14H22N2O3/c1-11-8-16(6-7-18-11)9-12(17)10-19-14-5-3-2-4-13(14)15/h2-5,11-12,17H,6-10,15H2,1H3
InChIKeyMEWCFDHENOKDOC-UHFFFAOYSA-N
XLogP0.73
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(2-aminophenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 43173893
1-(2-aminophenoxy)-3-pyrrolidin-1-ylpropan-2-ol
CID 43364467
1-(4-aminophenoxy)-3-(2-methyl-1,4-oxazepan-4-yl)propan-2-ol
CID 62987736
1-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]-3-(2-methylphenoxy)propan-2-ol
CID 110900539
1-(2-aminophenoxy)-3-(4-propylpiperidin-1-yl)propan-2-ol
CID 62199243
2-[3-(2-methyl-1,4-oxazepan-4-yl)propoxy]aniline
CID 62987901
(2S)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-(2-methylphenoxy)propan-2-ol
CID 7150363
1-[2-(aminomethyl)phenoxy]-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 43253374
1-(2-aminophenoxy)-3-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]propan-2-ol
CID 102777704
1-[4-(aminomethyl)phenoxy]-3-(2-methyl-1,4-oxazepan-4-yl)propan-2-ol
CID 62987229
1-(2-chlorophenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol;hydrochloride
CID 16807392
(2S)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-(2-propan-2-ylphenoxy)propan-2-ol
CID 7125674

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol?
The IUPAC name of 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol (CID 43364486) is 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol.
What is the SMILES notation for 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol?
The canonical SMILES for 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol is CC1CN(CC(O)COc2ccccc2N)CCO1.
What is the InChIKey of 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol?
The InChIKey is MEWCFDHENOKDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-11-8-16(6-7-18-11)9-12(17)10-19-14-5-3-2-4-13(14)15/h2-5,11-12,17H,6-10,15H2,1H3.
What are the key properties of 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol?
1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol has a molecular weight of 266.34 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenoxy)-3-(2-methylmorpholin-4-yl)propan-2-ol is sourced from PubChem (CID 43364486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).