2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide

C18H19NO3 — CID 22944662

IUPAC2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide
SMILESCC(=O)CCCc1ccc(NC(=O)c2ccccc2O)cc1
InChIInChI=1S/C18H19NO3/c1-13(20)5-4-6-14-9-11-15(12-10-14)19-18(22)16-7-2-3-8-17(16)21/h2-3,7-12,21H,4-6H2,1H3,(H,19,22)
InChIKeyMHOOQROAYIJQEZ-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.56
Rot. Bonds6

About 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide

2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide (PubChem CID 22944662) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide
PubChem CID22944662
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide
SMILESCC(=O)CCCc1ccc(NC(=O)c2ccccc2O)cc1
InChIInChI=1S/C18H19NO3/c1-13(20)5-4-6-14-9-11-15(12-10-14)19-18(22)16-7-2-3-8-17(16)21/h2-3,7-12,21H,4-6H2,1H3,(H,19,22)
InChIKeyMHOOQROAYIJQEZ-UHFFFAOYSA-N
XLogP3.56
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-[4-(2-hydroxyethyl)phenyl]benzamide
CID 61221414
N-[4-(2-aminoethyl)phenyl]-2-hydroxybenzamide
CID 62303022
N-[4-(4-oxopentyl)phenyl]-4-phenylbutanamide
CID 21335633
2-hydroxy-N-[4-(methylaminomethyl)phenyl]benzamide
CID 106909836
ethane;2-hydroxy-N-phenylbenzamide
CID 54170056
5-phenylpentan-2-one
CID 16701
2-hydroxy-N-phenylbenzamide
CID 157209959
N-(4-butylphenyl)-2-sulfanylbenzamide
CID 107022706
N-[4-(3-aminopropyl)phenyl]-2-methylbenzamide
CID 28754642
2-hydroxy-N-phenylbenzamide chloride
CID 19021936
2-amino-N-(4-pentylphenyl)benzamide
CID 16768967
5-[4-(ethylamino)phenyl]pentan-2-one
CID 71063356

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide?
The IUPAC name of 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide (CID 22944662) is 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide.
What is the SMILES notation for 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide?
The canonical SMILES for 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide is CC(=O)CCCc1ccc(NC(=O)c2ccccc2O)cc1.
What is the InChIKey of 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide?
The InChIKey is MHOOQROAYIJQEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-13(20)5-4-6-14-9-11-15(12-10-14)19-18(22)16-7-2-3-8-17(16)21/h2-3,7-12,21H,4-6H2,1H3,(H,19,22).
What are the key properties of 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide?
2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide has a molecular weight of 297.35 g/mol, XLogP of 3.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[4-(4-oxopentyl)phenyl]benzamide is sourced from PubChem (CID 22944662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).