(2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide

C16H17NO3 — CID 837411

IUPAC(2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide
SMILESCc1ccccc1O[C@H](C)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C16H17NO3/c1-11-5-3-4-6-15(11)20-12(2)16(19)17-13-7-9-14(18)10-8-13/h3-10,12,18H,1-2H3,(H,17,19)/t12-/m1/s1
InChIKeySIROKOTWIIHVCG-GFCCVEGCSA-N
MW271.32 g/mol
LogP3.11
Rot. Bonds4

About (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide

(2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide (PubChem CID 837411) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide
PubChem CID837411
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name(2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide
SMILESCc1ccccc1O[C@H](C)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C16H17NO3/c1-11-5-3-4-6-15(11)20-12(2)16(19)17-13-7-9-14(18)10-8-13/h3-10,12,18H,1-2H3,(H,17,19)/t12-/m1/s1
InChIKeySIROKOTWIIHVCG-GFCCVEGCSA-N
XLogP3.11
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methylphenoxy)-N-(4-propan-2-yloxyphenyl)propanamide
CID 17340229
N-[4-[2-(2-methylphenoxy)propanoylamino]phenyl]benzamide
CID 17235390
(2S)-2-(2-methylphenoxy)-N-[3-[[(2R)-2-(2-methylphenoxy)propanoyl]amino]phenyl]propanamide
CID 1019898
2-(2-methylphenoxy)-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 133166532
N-(4-bromo-3-methylphenyl)-2-(2-methylphenoxy)propanamide
CID 43876544
2-(2-methylphenoxy)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 133166702
2-(2,3-dimethylphenoxy)-N-phenylpropanamide
CID 43909351
2-(2-methylphenoxy)-N-[4-(pyrrolidine-1-carbonyl)phenyl]propanamide
CID 17196352
N-[4-[3-(methylamino)-3-oxopropyl]phenyl]-2-(2-methylphenoxy)propanamide
CID 54780693
2-(2-methylphenoxy)-N-pyridin-3-ylpropanamide
CID 2977750
N-[4-[[2-(2-methylphenoxy)propanoylamino]carbamoyl]phenyl]benzamide
CID 4931723
N-butyl-4-[2-(2-methylphenoxy)propanoylamino]benzamide
CID 17195203

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide (CID 837411) is (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide is Cc1ccccc1O[C@H](C)C(=O)Nc1ccc(O)cc1.
What is the InChIKey of (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide?
The InChIKey is SIROKOTWIIHVCG-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11-5-3-4-6-15(11)20-12(2)16(19)17-13-7-9-14(18)10-8-13/h3-10,12,18H,1-2H3,(H,17,19)/t12-/m1/s1.
What are the key properties of (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide?
(2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide has a molecular weight of 271.32 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-hydroxyphenyl)-2-(2-methylphenoxy)propanamide is sourced from PubChem (CID 837411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).