N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide

C17H18N2O3 — CID 11277927

IUPACN-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide
SMILESO=C(CCc1ccc(NC(=O)Cc2ccccc2)cc1)NO
InChIInChI=1S/C17H18N2O3/c20-16(19-22)11-8-13-6-9-15(10-7-13)18-17(21)12-14-4-2-1-3-5-14/h1-7,9-10,22H,8,11-12H2,(H,18,21)(H,19,20)
InChIKeyDQIPOWGRCAHTJS-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.31
Rot. Bonds6

About N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide

N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide (PubChem CID 11277927) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide.

Molecular Properties

Compound NameN-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide
PubChem CID11277927
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide
SMILESO=C(CCc1ccc(NC(=O)Cc2ccccc2)cc1)NO
InChIInChI=1S/C17H18N2O3/c20-16(19-22)11-8-13-6-9-15(10-7-13)18-17(21)12-14-4-2-1-3-5-14/h1-7,9-10,22H,8,11-12H2,(H,18,21)(H,19,20)
InChIKeyDQIPOWGRCAHTJS-UHFFFAOYSA-N
XLogP2.31
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Vorinostat
CID 5311
Ar-42
CID 6918848
N,N'-Diacetylbenzidine
CID 11942
Acetylbenzidine
CID 18787
Adipic dianilide
CID 20523
Benzanilide
CID 7168
4-(dimethylamino)-N-(7-(hydroxyamino)-7-oxoheptyl)benzamide
CID 3994
p-Malonotoluidide
CID 95277
N-benzoyl-N-phenylhydroxylamine
CID 67536
4'-Methylbenzanilide
CID 68497
N-Hydroxy-4-acetylaminobiphenyl
CID 20527
SK-7041
CID 6918714

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide?
The IUPAC name of N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide (CID 11277927) is N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide.
What is the SMILES notation for N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide?
The canonical SMILES for N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide is O=C(CCc1ccc(NC(=O)Cc2ccccc2)cc1)NO.
What is the InChIKey of N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide?
The InChIKey is DQIPOWGRCAHTJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c20-16(19-22)11-8-13-6-9-15(10-7-13)18-17(21)12-14-4-2-1-3-5-14/h1-7,9-10,22H,8,11-12H2,(H,18,21)(H,19,20).
What are the key properties of N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide?
N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide has a molecular weight of 298.34 g/mol, XLogP of 2.31, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-3-[4-[(2-phenylacetyl)amino]phenyl]propanamide is sourced from PubChem (CID 11277927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).