[4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol

C16H26N2O2 — CID 102936336

IUPAC[4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(CC(C)C(N)c2ccccc2)CC(CO)O1
InChIInChI=1S/C16H26N2O2/c1-12(16(17)14-6-4-3-5-7-14)8-18-9-13(2)20-15(10-18)11-19/h3-7,12-13,15-16,19H,8-11,17H2,1-2H3
InChIKeyYEAVBNRAHSYKKD-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.40
Rot. Bonds5

About [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol

[4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol (PubChem CID 102936336) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol
PubChem CID102936336
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name[4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol
SMILESCC1CN(CC(C)C(N)c2ccccc2)CC(CO)O1
InChIInChI=1S/C16H26N2O2/c1-12(16(17)14-6-4-3-5-7-14)8-18-9-13(2)20-15(10-18)11-19/h3-7,12-13,15-16,19H,8-11,17H2,1-2H3
InChIKeyYEAVBNRAHSYKKD-UHFFFAOYSA-N
XLogP1.40
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol with MolForge

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Related Compounds

(1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine
CID 30072743
1-[1-(3-amino-2-methyl-3-phenylpropyl)piperidin-4-yl]ethanol
CID 106837864
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanol
CID 103936768
3-(1,3-dihydroisoindol-2-yl)-2-methyl-1-phenylpropan-1-amine
CID 62619441
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-phenylpropan-2-amine
CID 104959145
2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-methyl-N-phenylacetamide
CID 102935696
3-(2,6-dimethylmorpholin-4-yl)-N'-hydroxy-2-phenylpropanimidamide
CID 77043553
[4-[2-amino-1-(3-methylphenyl)propyl]-6-methylmorpholin-2-yl]methanol
CID 102932113
3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-1-(2-methylphenyl)propan-1-ol
CID 102936466
1-(4-aminophenoxy)-3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propan-2-ol
CID 102932193
[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
CID 102932218
3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-methyl-2-phenylpropanal
CID 102936299

Frequently Asked Questions

What is the IUPAC name of [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol (CID 102936336) is [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol is CC1CN(CC(C)C(N)c2ccccc2)CC(CO)O1.
What is the InChIKey of [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol?
The InChIKey is YEAVBNRAHSYKKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-12(16(17)14-6-4-3-5-7-14)8-18-9-13(2)20-15(10-18)11-19/h3-7,12-13,15-16,19H,8-11,17H2,1-2H3.
What are the key properties of [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol?
[4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol has a molecular weight of 278.40 g/mol, XLogP of 1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102936336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).