N'-(4-aminobenzoyl)-3-methoxybenzohydrazide

C15H15N3O3 — CID 684303

IUPACN'-(4-aminobenzoyl)-3-methoxybenzohydrazide
SMILESCOc1cccc(C(=O)NNC(=O)c2ccc(N)cc2)c1
InChIInChI=1S/C15H15N3O3/c1-21-13-4-2-3-11(9-13)15(20)18-17-14(19)10-5-7-12(16)8-6-10/h2-9H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyRLEGRCJRGVLICD-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.35
Rot. Bonds3

About N'-(4-aminobenzoyl)-3-methoxybenzohydrazide

N'-(4-aminobenzoyl)-3-methoxybenzohydrazide (PubChem CID 684303) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N'-(4-aminobenzoyl)-3-methoxybenzohydrazide.

Molecular Properties

Compound NameN'-(4-aminobenzoyl)-3-methoxybenzohydrazide
PubChem CID684303
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN'-(4-aminobenzoyl)-3-methoxybenzohydrazide
SMILESCOc1cccc(C(=O)NNC(=O)c2ccc(N)cc2)c1
InChIInChI=1S/C15H15N3O3/c1-21-13-4-2-3-11(9-13)15(20)18-17-14(19)10-5-7-12(16)8-6-10/h2-9H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyRLEGRCJRGVLICD-UHFFFAOYSA-N
XLogP1.35
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-aminophenyl)-3-methoxybenzamide
CID 8566724
N-[(4-aminophenyl)carbamothioyl]-3-methoxybenzamide
CID 87563448
3-methoxy-N'-pentanoylbenzohydrazide
CID 3117671
N'-(2-cyanoacetyl)-3-methoxybenzohydrazide
CID 3117668
4-amino-N-[1-(3-methoxyphenyl)ethyl]benzamide
CID 60927518
4-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]benzamide
CID 81373217
N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide
CID 7941736
N-(4-amino-2,6-dibromophenyl)-3-methoxybenzamide
CID 43549420
3-[[(3-methoxybenzoyl)amino]carbamoyl]-N,N-dimethylbenzenesulfonamide
CID 9473161
3-methoxy-N'-[2-(2-methoxyphenoxy)acetyl]benzohydrazide
CID 7720061
3-methoxy-N'-[(2S)-2-methoxy-2-phenylacetyl]benzohydrazide
CID 40541391
3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
CID 2167030

Frequently Asked Questions

What is the IUPAC name of N'-(4-aminobenzoyl)-3-methoxybenzohydrazide?
The IUPAC name of N'-(4-aminobenzoyl)-3-methoxybenzohydrazide (CID 684303) is N'-(4-aminobenzoyl)-3-methoxybenzohydrazide.
What is the SMILES notation for N'-(4-aminobenzoyl)-3-methoxybenzohydrazide?
The canonical SMILES for N'-(4-aminobenzoyl)-3-methoxybenzohydrazide is COc1cccc(C(=O)NNC(=O)c2ccc(N)cc2)c1.
What is the InChIKey of N'-(4-aminobenzoyl)-3-methoxybenzohydrazide?
The InChIKey is RLEGRCJRGVLICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-21-13-4-2-3-11(9-13)15(20)18-17-14(19)10-5-7-12(16)8-6-10/h2-9H,16H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N'-(4-aminobenzoyl)-3-methoxybenzohydrazide?
N'-(4-aminobenzoyl)-3-methoxybenzohydrazide has a molecular weight of 285.30 g/mol, XLogP of 1.35, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-aminobenzoyl)-3-methoxybenzohydrazide is sourced from PubChem (CID 684303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).