[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol

C16H25NO2 — CID 99108798

IUPAC[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol
SMILESCC(C)c1ccc([C@@H](C)N2CCO[C@@H](CO)C2)cc1
InChIInChI=1S/C16H25NO2/c1-12(2)14-4-6-15(7-5-14)13(3)17-8-9-19-16(10-17)11-18/h4-7,12-13,16,18H,8-11H2,1-3H3/t13-,16-/m1/s1
InChIKeyNAOHLSLOFDOBLS-CZUORRHYSA-N
MW263.38 g/mol
LogP2.56
Rot. Bonds4

About [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol

[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol (PubChem CID 99108798) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol
PubChem CID99108798
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol
SMILESCC(C)c1ccc([C@@H](C)N2CCO[C@@H](CO)C2)cc1
InChIInChI=1S/C16H25NO2/c1-12(2)14-4-6-15(7-5-14)13(3)17-8-9-19-16(10-17)11-18/h4-7,12-13,16,18H,8-11H2,1-3H3/t13-,16-/m1/s1
InChIKeyNAOHLSLOFDOBLS-CZUORRHYSA-N
XLogP2.56
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[1-[2-(hydroxymethyl)morpholin-4-yl]ethyl]furan-2-carboxylic acid
CID 81204459
cyclopropyl-[(2R)-4-[(1S)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanone
CID 124737738
2-[4-[1-(4-bromophenyl)ethyl]morpholin-2-yl]acetic acid
CID 66433752
[4-[1-(3,4-dimethylphenyl)ethyl]morpholin-2-yl]methanamine
CID 114397830
4-[1-(2-methylmorpholin-4-yl)ethyl]phenol
CID 82977780
1-(4-ethylphenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]propan-1-one
CID 81204702
[4-[2-amino-1-(4-bromophenyl)ethyl]morpholin-2-yl]methanol
CID 81206159
[4-[2-amino-1-(3-fluorophenyl)propyl]morpholin-2-yl]methanol
CID 81205350
2-(hydroxymethyl)-N-[3-(4-propan-2-ylphenyl)propyl]morpholine-4-carboxamide
CID 71924014
[4-[1-(3,4-difluorophenyl)ethyl]morpholin-2-yl]methanamine;hydrochloride
CID 85086626
1-(2,4-dichlorophenyl)-2-[2-(hydroxymethyl)morpholin-4-yl]propan-1-one
CID 81204933
[4-(2-amino-1-pyridin-2-ylpropyl)morpholin-2-yl]methanol
CID 81205655

Frequently Asked Questions

What is the IUPAC name of [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol?
The IUPAC name of [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol (CID 99108798) is [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol.
What is the SMILES notation for [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol?
The canonical SMILES for [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol is CC(C)c1ccc([C@@H](C)N2CCO[C@@H](CO)C2)cc1.
What is the InChIKey of [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol?
The InChIKey is NAOHLSLOFDOBLS-CZUORRHYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-12(2)14-4-6-15(7-5-14)13(3)17-8-9-19-16(10-17)11-18/h4-7,12-13,16,18H,8-11H2,1-3H3/t13-,16-/m1/s1.
What are the key properties of [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol?
[(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol has a molecular weight of 263.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4-[(1R)-1-(4-propan-2-ylphenyl)ethyl]morpholin-2-yl]methanol is sourced from PubChem (CID 99108798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).