[4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol

C13H20N2O2 — CID 81204899

IUPAC[4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol
SMILESCC(N)c1ccccc1N1CCOC(CO)C1
InChIInChI=1S/C13H20N2O2/c1-10(14)12-4-2-3-5-13(12)15-6-7-17-11(8-15)9-16/h2-5,10-11,16H,6-9,14H2,1H3
InChIKeyVYXFFHLCYCXACN-UHFFFAOYSA-N
MW236.31 g/mol
LogP0.90
Rot. Bonds3

About [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol

[4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol (PubChem CID 81204899) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol
PubChem CID81204899
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol
SMILESCC(N)c1ccccc1N1CCOC(CO)C1
InChIInChI=1S/C13H20N2O2/c1-10(14)12-4-2-3-5-13(12)15-6-7-17-11(8-15)9-16/h2-5,10-11,16H,6-9,14H2,1H3
InChIKeyVYXFFHLCYCXACN-UHFFFAOYSA-N
XLogP0.90
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[4-[(1R)-1-aminoethyl]-2-chlorophenyl]morpholin-2-yl]methanol
CID 81204298
[4-[4-(1-aminoethyl)-3-chlorophenyl]morpholin-2-yl]methanol
CID 81204221
1-[3-fluoro-2-[2-(hydroxymethyl)morpholin-4-yl]phenyl]ethanol
CID 114059212
[4-[2-(ethylaminomethyl)phenyl]morpholin-2-yl]methanol
CID 81204640
[4-[4-[(1R)-1-aminoethyl]-2-pyridinyl]morpholin-2-yl]methanol
CID 81205057
[4-[2-(aminomethyl)-3-chlorophenyl]morpholin-2-yl]methanol
CID 81205346
[4-(2-nitrophenyl)morpholin-2-yl]methanol
CID 79839619
N-[1-[2-(2-ethylmorpholin-4-yl)phenyl]ethyl]propan-1-amine
CID 43562783
[4-(4-amino-2-methylphenyl)morpholin-2-yl]methanol
CID 81205635
1-[2-(3-methylpyrrolidin-1-yl)phenyl]ethanamine
CID 61224430
2-[4-[2-[(1S)-1-aminoethyl]phenyl]piperazin-1-yl]ethanol
CID 55189416
2-(2-ethylmorpholin-4-yl)aniline
CID 43562435

Frequently Asked Questions

What is the IUPAC name of [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol (CID 81204899) is [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol is CC(N)c1ccccc1N1CCOC(CO)C1.
What is the InChIKey of [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol?
The InChIKey is VYXFFHLCYCXACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(14)12-4-2-3-5-13(12)15-6-7-17-11(8-15)9-16/h2-5,10-11,16H,6-9,14H2,1H3.
What are the key properties of [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol?
[4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol has a molecular weight of 236.31 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(1-aminoethyl)phenyl]morpholin-2-yl]methanol is sourced from PubChem (CID 81204899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).