N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide

C16H17NO3 — CID 60607631

IUPACN-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)NCc1ccccc1O
InChIInChI=1S/C16H17NO3/c1-12(20-14-8-3-2-4-9-14)16(19)17-11-13-7-5-6-10-15(13)18/h2-10,12,18H,11H2,1H3,(H,17,19)
InChIKeyCEWYUWZXRUCZLV-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.48
Rot. Bonds5

About N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide

N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide (PubChem CID 60607631) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide
PubChem CID60607631
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide
SMILESCC(Oc1ccccc1)C(=O)NCc1ccccc1O
InChIInChI=1S/C16H17NO3/c1-12(20-14-8-3-2-4-9-14)16(19)17-11-13-7-5-6-10-15(13)18/h2-10,12,18H,11H2,1H3,(H,17,19)
InChIKeyCEWYUWZXRUCZLV-UHFFFAOYSA-N
XLogP2.48
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[(2-methylphenyl)methyl]-2-phenoxypropanamide
CID 41013253
(2R)-2-phenoxy-N-[2-[[(2R)-2-phenoxypropanoyl]amino]ethyl]propanamide
CID 7039405
N-ethyl-2-phenoxypropanamide
CID 4282518
(2R)-N-[(2,5-dimethylfuran-3-yl)methyl]-2-phenoxypropanamide
CID 95368385
(2S)-2-phenoxy-N-[9-[[(2S)-2-phenoxypropanoyl]amino]nonyl]propanamide
CID 28839964
(2R)-N-[(4-methylphenyl)methyl]-2-phenoxypropanamide
CID 670065
(2R)-2-phenoxy-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 93234508
N-[(2-fluorophenyl)methyl]-2-(4-hydroxyphenoxy)propanamide
CID 56983513
2-phenoxy-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]propanamide
CID 51237843
2-(4-methylphenoxy)-N-[(2-methylphenyl)methyl]propanamide
CID 46807295
(2S)-2-phenoxy-N-(pyridin-4-ylmethyl)propanamide
CID 670240
(2S)-N-[(4-methoxyphenyl)methyl]-2-phenoxypropanamide
CID 831480

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide?
The IUPAC name of N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide (CID 60607631) is N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide is CC(Oc1ccccc1)C(=O)NCc1ccccc1O.
What is the InChIKey of N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide?
The InChIKey is CEWYUWZXRUCZLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-12(20-14-8-3-2-4-9-14)16(19)17-11-13-7-5-6-10-15(13)18/h2-10,12,18H,11H2,1H3,(H,17,19).
What are the key properties of N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide?
N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide has a molecular weight of 271.32 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxyphenyl)methyl]-2-phenoxypropanamide is sourced from PubChem (CID 60607631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).