[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol

C14H22N2O2 — CID 102932218

IUPAC[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(C(C)c2cccc(N)c2)CC(CO)O1
InChIInChI=1S/C14H22N2O2/c1-10-7-16(8-14(9-17)18-10)11(2)12-4-3-5-13(15)6-12/h3-6,10-11,14,17H,7-9,15H2,1-2H3
InChIKeyDMDCFBOAJUFVAZ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.41
Rot. Bonds3

About [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol

[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol (PubChem CID 102932218) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
PubChem CID102932218
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(C(C)c2cccc(N)c2)CC(CO)O1
InChIInChI=1S/C14H22N2O2/c1-10-7-16(8-14(9-17)18-10)11(2)12-4-3-5-13(15)6-12/h3-6,10-11,14,17H,7-9,15H2,1-2H3
InChIKeyDMDCFBOAJUFVAZ-UHFFFAOYSA-N
XLogP1.41
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(3-aminophenyl)ethyl]pyrrolidine-3,4-diol
CID 106667852
[4-[2-amino-1-(3-methylphenyl)propyl]-6-methylmorpholin-2-yl]methanol
CID 102932113
3-[1-(3,5-dimethylpiperidin-1-yl)ethyl]aniline
CID 61263126
3-[1-(2-methylmorpholin-4-yl)ethyl]aniline
CID 61262196
[4-[2-amino-1-(3-chlorophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
CID 102932163
[4-(3-aminophenyl)sulfonyl-6-methylmorpholin-2-yl]methanol
CID 102931873
3-[1-(3-methylpiperidin-1-yl)ethyl]aniline
CID 61262194
3-[1-(3,4-dimethylpiperazin-1-yl)ethyl]aniline
CID 63603446
1-[1-(3-aminophenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63166588
[6-methyl-4-(1-pyrazin-2-ylethyl)morpholin-2-yl]methanol
CID 136535011
[4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol
CID 102932082
3-[1-(azepan-1-yl)ethyl]aniline
CID 61262195

Frequently Asked Questions

What is the IUPAC name of [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol (CID 102932218) is [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol is CC1CN(C(C)c2cccc(N)c2)CC(CO)O1.
What is the InChIKey of [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is DMDCFBOAJUFVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10-7-16(8-14(9-17)18-10)11(2)12-4-3-5-13(15)6-12/h3-6,10-11,14,17H,7-9,15H2,1-2H3.
What are the key properties of [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol?
[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 250.34 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102932218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).