3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide

C16H17NO3 — CID 110024303

IUPAC3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide
SMILESNC(=O)CC(O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C16H17NO3/c17-16(19)10-15(18)13-6-8-14(9-7-13)20-11-12-4-2-1-3-5-12/h1-9,15,18H,10-11H2,(H2,17,19)
InChIKeyCXXSRSGCIMWAQI-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.17
Rot. Bonds6

About 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide

3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide (PubChem CID 110024303) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide.

Molecular Properties

Compound Name3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide
PubChem CID110024303
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide
SMILESNC(=O)CC(O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C16H17NO3/c17-16(19)10-15(18)13-6-8-14(9-7-13)20-11-12-4-2-1-3-5-12/h1-9,15,18H,10-11H2,(H2,17,19)
InChIKeyCXXSRSGCIMWAQI-UHFFFAOYSA-N
XLogP2.17
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-2-oxo-4-(4-phenylmethoxyphenyl)butanoic acid
CID 46843455
3-hydroxy-3-(3-phenylmethoxyphenyl)propanamide
CID 68644594
(1R)-1-(4-phenylmethoxyphenyl)ethane-1,2-diol
CID 71416199
N,4-dihydroxy-N-methyl-2-oxo-4-(4-phenylmethoxyphenyl)butanamide
CID 174676377
3-hydroxy-3-(4-phenylmethoxyphenyl)propanal
CID 114795255
2-(4-phenylmethoxyphenyl)pentanediamide
CID 20546418
2-methoxy-1-(4-phenylmethoxyphenyl)ethanol
CID 13050554
1-amino-2-(4-phenylmethoxyphenyl)ethane-1,2-diol
CID 70474392
2-chloro-N-[(2R)-2-hydroxy-2-(4-phenylmethoxyphenyl)ethyl]acetamide
CID 124560470
benzyl 3-hydroxy-3-phenylpropanoate
CID 15466820
(3R)-3-hydroxy-2,2-dimethyl-3-(4-phenylmethoxyphenyl)propanoic acid
CID 96839766
1-(4-phenylmethoxyphenyl)hexan-1-ol
CID 65145694

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide?
The IUPAC name of 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide (CID 110024303) is 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide.
What is the SMILES notation for 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide?
The canonical SMILES for 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide is NC(=O)CC(O)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide?
The InChIKey is CXXSRSGCIMWAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c17-16(19)10-15(18)13-6-8-14(9-7-13)20-11-12-4-2-1-3-5-12/h1-9,15,18H,10-11H2,(H2,17,19).
What are the key properties of 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide?
3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide has a molecular weight of 271.32 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide is sourced from PubChem (CID 110024303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).