N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide

C15H15N3O4 — CID 162675840

IUPACN-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide
SMILESCOc1ccc(NC(=O)Nc2ccc(C(=O)NO)cc2)cc1
InChIInChI=1S/C15H15N3O4/c1-22-13-8-6-12(7-9-13)17-15(20)16-11-4-2-10(3-5-11)14(19)18-21/h2-9,21H,1H3,(H,18,19)(H2,16,17,20)
InChIKeyIXUUXMKJAWDHKP-UHFFFAOYSA-N
MW301.30 g/mol
LogP2.46
Rot. Bonds4

About N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide

N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide (PubChem CID 162675840) has the molecular formula C15H15N3O4 and a molecular weight of 301.30 g/mol. Its IUPAC name is N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide
PubChem CID162675840
Molecular FormulaC15H15N3O4
Molecular Weight301.30 g/mol
Exact Mass301.11
IUPAC NameN-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide
SMILESCOc1ccc(NC(=O)Nc2ccc(C(=O)NO)cc2)cc1
InChIInChI=1S/C15H15N3O4/c1-22-13-8-6-12(7-9-13)17-15(20)16-11-4-2-10(3-5-11)14(19)18-21/h2-9,21H,1H3,(H,18,19)(H2,16,17,20)
InChIKeyIXUUXMKJAWDHKP-UHFFFAOYSA-N
XLogP2.46
TPSA99.69 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.30
LogP ≤ 52.46
H-Bond Donors ≤ 54
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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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide?
The IUPAC name of N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide (CID 162675840) is N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide.
What is the SMILES notation for N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide?
The canonical SMILES for N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide is COc1ccc(NC(=O)Nc2ccc(C(=O)NO)cc2)cc1.
What is the InChIKey of N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide?
The InChIKey is IXUUXMKJAWDHKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O4/c1-22-13-8-6-12(7-9-13)17-15(20)16-11-4-2-10(3-5-11)14(19)18-21/h2-9,21H,1H3,(H,18,19)(H2,16,17,20).
What are the key properties of N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide?
N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide has a molecular weight of 301.30 g/mol, XLogP of 2.46, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[(4-methoxyphenyl)carbamoylamino]benzamide is sourced from PubChem (CID 162675840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).