N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide

C18H15ClN2O4 — CID 55787551

IUPACN'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide
SMILESCOc1ccc2oc(C)c(C(=O)NNC(=O)c3ccccc3Cl)c2c1
InChIInChI=1S/C18H15ClN2O4/c1-10-16(13-9-11(24-2)7-8-15(13)25-10)18(23)21-20-17(22)12-5-3-4-6-14(12)19/h3-9H,1-2H3,(H,20,22)(H,21,23)
InChIKeyVGNQURUAHLODKD-UHFFFAOYSA-N
MW358.78 g/mol
LogP3.48
Rot. Bonds3

About N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide

N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide (PubChem CID 55787551) has the molecular formula C18H15ClN2O4 and a molecular weight of 358.78 g/mol. Its IUPAC name is N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide.

Molecular Properties

Compound NameN'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide
PubChem CID55787551
Molecular FormulaC18H15ClN2O4
Molecular Weight358.78 g/mol
Exact Mass358.07
IUPAC NameN'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide
SMILESCOc1ccc2oc(C)c(C(=O)NNC(=O)c3ccccc3Cl)c2c1
InChIInChI=1S/C18H15ClN2O4/c1-10-16(13-9-11(24-2)7-8-15(13)25-10)18(23)21-20-17(22)12-5-3-4-6-14(12)19/h3-9H,1-2H3,(H,20,22)(H,21,23)
InChIKeyVGNQURUAHLODKD-UHFFFAOYSA-N
XLogP3.48
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.78
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-chlorophenyl)methyl]-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 51065486
N'-[2-(4-chlorophenyl)sulfanylacetyl]-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide
CID 78886337
(5-methoxy-2-methyl-1-benzofuran-3-yl)-phenylmethanone
CID 900013
N-(2-bromophenyl)-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 51065520
N-cyclohexyl-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 1130073
5-methoxy-2-methyl-N-(3-methylphenyl)-1-benzofuran-3-carboxamide
CID 51065526
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 94029246
2-[(5-methoxy-2-methyl-1-benzofuran-3-carbonyl)amino]propanoic acid
CID 82043387
2-chloro-N'-(4-methoxybenzoyl)benzohydrazide
CID 2170875
N-[2-(3-chlorophenoxy)ethyl]-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 55793954
N-(4-chloro-3-nitrophenyl)-5-methoxy-2-methyl-1-benzofuran-3-carboxamide
CID 51065498
N-(2,4-dimethoxyphenyl)-2-methyl-1-benzofuran-3-carboxamide
CID 110703181

Frequently Asked Questions

What is the IUPAC name of N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide?
The IUPAC name of N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide (CID 55787551) is N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide.
What is the SMILES notation for N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide?
The canonical SMILES for N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide is COc1ccc2oc(C)c(C(=O)NNC(=O)c3ccccc3Cl)c2c1.
What is the InChIKey of N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide?
The InChIKey is VGNQURUAHLODKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O4/c1-10-16(13-9-11(24-2)7-8-15(13)25-10)18(23)21-20-17(22)12-5-3-4-6-14(12)19/h3-9H,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide?
N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide has a molecular weight of 358.78 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chlorobenzoyl)-5-methoxy-2-methyl-1-benzofuran-3-carbohydrazide is sourced from PubChem (CID 55787551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).