N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide

C18H20N2O3 — CID 11151102

IUPACN-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide
SMILESO=C(CCCc1ccccc1)NCc1ccc(C(=O)NO)cc1
InChIInChI=1S/C18H20N2O3/c21-17(8-4-7-14-5-2-1-3-6-14)19-13-15-9-11-16(12-10-15)18(22)20-23/h1-3,5-6,9-12,23H,4,7-8,13H2,(H,19,21)(H,20,22)
InChIKeyFWHDHMRBZJFCKU-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.44
Rot. Bonds7

About N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide

N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide (PubChem CID 11151102) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide
PubChem CID11151102
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide
SMILESO=C(CCCc1ccccc1)NCc1ccc(C(=O)NO)cc1
InChIInChI=1S/C18H20N2O3/c21-17(8-4-7-14-5-2-1-3-6-14)19-13-15-9-11-16(12-10-15)18(22)20-23/h1-3,5-6,9-12,23H,4,7-8,13H2,(H,19,21)(H,20,22)
InChIKeyFWHDHMRBZJFCKU-UHFFFAOYSA-N
XLogP2.44
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.44
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

N-Propylbenzamide
CID 25354
AR-M1000390
CID 9841259
N-Ethylbenzamide
CID 11959
N-Butylbenzamide
CID 76024
N-(1-(Phenylmethyl)-4-piperidinyl)benzamide
CID 40598
N-Benzoylbenzylamine
CID 73878
4-methyl-N-(2-phenylethyl)benzamide
CID 723105
4-(1,1-Dimethylethyl)-N-(phenylmethyl)benzamide
CID 809338
N-Phenacylbenzamide
CID 259631
N,N-diethyl-4-((3-fluorophenyl)(piperidin-4-ylidene)methyl)benzamide
CID 10570940
N-(2-Methylpropyl)benzamide
CID 95140
ChiRYun
CID 389617

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide?
The IUPAC name of N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide (CID 11151102) is N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide?
The canonical SMILES for N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide is O=C(CCCc1ccccc1)NCc1ccc(C(=O)NO)cc1.
What is the InChIKey of N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide?
The InChIKey is FWHDHMRBZJFCKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c21-17(8-4-7-14-5-2-1-3-6-14)19-13-15-9-11-16(12-10-15)18(22)20-23/h1-3,5-6,9-12,23H,4,7-8,13H2,(H,19,21)(H,20,22).
What are the key properties of N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide?
N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide has a molecular weight of 312.37 g/mol, XLogP of 2.44, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[(4-phenylbutanoylamino)methyl]benzamide is sourced from PubChem (CID 11151102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).