N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide

C15H16N2O3 — CID 110487034

IUPACN-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide
SMILESO=C(CCCOc1cccnc1)Nc1ccccc1O
InChIInChI=1S/C15H16N2O3/c18-14-7-2-1-6-13(14)17-15(19)8-4-10-20-12-5-3-9-16-11-12/h1-3,5-7,9,11,18H,4,8,10H2,(H,17,19)
InChIKeyXFCLRCKTVNVRCO-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.58
Rot. Bonds6

About N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide

N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide (PubChem CID 110487034) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide
PubChem CID110487034
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide
SMILESO=C(CCCOc1cccnc1)Nc1ccccc1O
InChIInChI=1S/C15H16N2O3/c18-14-7-2-1-6-13(14)17-15(19)8-4-10-20-12-5-3-9-16-11-12/h1-3,5-7,9,11,18H,4,8,10H2,(H,17,19)
InChIKeyXFCLRCKTVNVRCO-UHFFFAOYSA-N
XLogP2.58
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-hydroxyphenyl)-4-pyridin-3-yloxybutanamide
CID 110487035
N-[2-(3-aminopropanoylamino)phenyl]-4-phenoxybutanamide
CID 82034361
4-hydroxy-3-(4-phenoxybutanoylamino)benzoic acid
CID 108753979
3-hydroxy-2-(4-pyridin-3-yloxybutanoylamino)propanoic acid
CID 110486969
N-(2-ethylphenyl)-2-pyridin-3-yloxyacetamide
CID 38114602
N-[2-[4-(2-methylphenoxy)butanoylamino]phenyl]pyridine-3-carboxamide
CID 108925317
N-(2-hydroxy-5-methylphenyl)-2-pyridin-3-yloxyacetamide
CID 110487929
N,N-dimethyl-4-pyridin-3-yloxybutanamide
CID 110486958
N,N'-bis[2-(2-phenoxyethoxy)phenyl]pentanediamide
CID 17131186
3-(3-phenoxypropoxy)pyridine
CID 86195847
N,N'-bis[2-(2-phenoxyethoxy)phenyl]decanediamide
CID 17130993
3-(3-pyridin-3-yloxypropanoylamino)propanoic acid
CID 110837112

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide?
The IUPAC name of N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide (CID 110487034) is N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide?
The canonical SMILES for N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide is O=C(CCCOc1cccnc1)Nc1ccccc1O.
What is the InChIKey of N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide?
The InChIKey is XFCLRCKTVNVRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c18-14-7-2-1-6-13(14)17-15(19)8-4-10-20-12-5-3-9-16-11-12/h1-3,5-7,9,11,18H,4,8,10H2,(H,17,19).
What are the key properties of N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide?
N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide has a molecular weight of 272.30 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-4-pyridin-3-yloxybutanamide is sourced from PubChem (CID 110487034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).