N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide

C17H18N2O4 — CID 58417539

IUPACN-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide
SMILESCOc1ccc(C(=O)N[C@H](C)c2ccc(C(=O)NO)cc2)cc1
InChIInChI=1S/C17H18N2O4/c1-11(12-3-5-14(6-4-12)17(21)19-22)18-16(20)13-7-9-15(23-2)10-8-13/h3-11,22H,1-2H3,(H,18,20)(H,19,21)/t11-/m1/s1
InChIKeyPBYBKBQNIIXWJO-LLVKDONJSA-N
MW314.34 g/mol
LogP2.31
Rot. Bonds5

About N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide

N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide (PubChem CID 58417539) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide
PubChem CID58417539
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC NameN-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide
SMILESCOc1ccc(C(=O)N[C@H](C)c2ccc(C(=O)NO)cc2)cc1
InChIInChI=1S/C17H18N2O4/c1-11(12-3-5-14(6-4-12)17(21)19-22)18-16(20)13-7-9-15(23-2)10-8-13/h3-11,22H,1-2H3,(H,18,20)(H,19,21)/t11-/m1/s1
InChIKeyPBYBKBQNIIXWJO-LLVKDONJSA-N
XLogP2.31
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

1-N,4-N-bis[(1S)-1-(4-methoxyphenyl)ethyl]benzene-1,4-dicarboxamide
CID 2211003
4-amino-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 81364308
N-[1-(4-fluorophenyl)ethyl]-4-methoxybenzamide
CID 17406706
N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-phenylbenzamide
CID 977346
N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-methoxybenzamide
CID 880654
4-methoxy-N-[(1R)-1-(4-methylsulfanylphenyl)ethyl]benzamide
CID 28558127
3,4-dimethoxy-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 831207
4-methoxy-N-[(1R)-1-naphthalen-2-ylethyl]benzamide
CID 977744
N-[(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-4-methoxybenzamide
CID 8962855
4-(ethylsulfonylamino)-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 94027949
N-[1-(4-methoxyphenyl)ethyl]-4-piperidin-1-ylbenzamide
CID 43910482
N-[1-(4-methoxyphenyl)ethyl]-4-[methyl(methylsulfonyl)amino]benzamide
CID 53279777

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide?
The IUPAC name of N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide (CID 58417539) is N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide?
The canonical SMILES for N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide is COc1ccc(C(=O)N[C@H](C)c2ccc(C(=O)NO)cc2)cc1.
What is the InChIKey of N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide?
The InChIKey is PBYBKBQNIIXWJO-LLVKDONJSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-11(12-3-5-14(6-4-12)17(21)19-22)18-16(20)13-7-9-15(23-2)10-8-13/h3-11,22H,1-2H3,(H,18,20)(H,19,21)/t11-/m1/s1.
What are the key properties of N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide?
N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide has a molecular weight of 314.34 g/mol, XLogP of 2.31, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide is sourced from PubChem (CID 58417539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).