N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide

C17H17ClN2O4 — CID 35930751

IUPACN'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide
SMILESCOc1cc(C(=O)NNC(=O)c2ccccc2Cl)cc(OC)c1C
InChIInChI=1S/C17H17ClN2O4/c1-10-14(23-2)8-11(9-15(10)24-3)16(21)19-20-17(22)12-6-4-5-7-13(12)18/h4-9H,1-3H3,(H,19,21)(H,20,22)
InChIKeyAHUNCQMIEAFUGB-UHFFFAOYSA-N
MW348.79 g/mol
LogP2.74
Rot. Bonds4

About N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide

N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide (PubChem CID 35930751) has the molecular formula C17H17ClN2O4 and a molecular weight of 348.79 g/mol. Its IUPAC name is N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide.

Molecular Properties

Compound NameN'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide
PubChem CID35930751
Molecular FormulaC17H17ClN2O4
Molecular Weight348.79 g/mol
Exact Mass348.09
IUPAC NameN'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide
SMILESCOc1cc(C(=O)NNC(=O)c2ccccc2Cl)cc(OC)c1C
InChIInChI=1S/C17H17ClN2O4/c1-10-14(23-2)8-11(9-15(10)24-3)16(21)19-20-17(22)12-6-4-5-7-13(12)18/h4-9H,1-3H3,(H,19,21)(H,20,22)
InChIKeyAHUNCQMIEAFUGB-UHFFFAOYSA-N
XLogP2.74
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.79
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-N'-(2-chlorobenzoyl)-5-methoxy-4-propoxybenzohydrazide
CID 35930780
3,5-dichloro-N'-(2-methoxybenzoyl)benzohydrazide
CID 17133653
N'-(2-chlorobenzoyl)-3,4,5-triethoxybenzohydrazide
CID 7964784
2-chloro-N'-(4-methoxybenzoyl)benzohydrazide
CID 2170875
N'-(2-chlorobenzoyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzohydrazide
CID 35929028
N'-(3,5-dimethoxy-4-methylbenzoyl)-2,5-dimethyl-1-phenylpyrrole-3-carbohydrazide
CID 30475355
3-bromo-N'-(2-chlorobenzoyl)-4-(2-methoxyethoxy)benzohydrazide
CID 17356627
2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide
CID 17353590
N-[2-[[(2,4-dichlorobenzoyl)amino]carbamoyl]phenyl]-3,4,5-trimethoxybenzamide
CID 126005822
2,6-dichloro-N'-(3,4-dimethoxybenzoyl)benzohydrazide
CID 78770574
N'-benzoyl-4-chloro-2-methoxybenzohydrazide
CID 34594179
2,3-dichloro-N'-(3-methoxy-4-propan-2-yloxybenzoyl)benzohydrazide
CID 26655741

Frequently Asked Questions

What is the IUPAC name of N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide?
The IUPAC name of N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide (CID 35930751) is N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide.
What is the SMILES notation for N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide?
The canonical SMILES for N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide is COc1cc(C(=O)NNC(=O)c2ccccc2Cl)cc(OC)c1C.
What is the InChIKey of N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide?
The InChIKey is AHUNCQMIEAFUGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O4/c1-10-14(23-2)8-11(9-15(10)24-3)16(21)19-20-17(22)12-6-4-5-7-13(12)18/h4-9H,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide?
N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide has a molecular weight of 348.79 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorobenzoyl)-3,5-dimethoxy-4-methylbenzohydrazide is sourced from PubChem (CID 35930751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).