N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide

C20H18N2O5 — CID 34977030

IUPACN'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2occc2-c2ccccc2)cc1OC
InChIInChI=1S/C20H18N2O5/c1-25-16-9-8-14(12-17(16)26-2)19(23)21-22-20(24)18-15(10-11-27-18)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyJWPWZLXZABVIPN-UHFFFAOYSA-N
MW366.37 g/mol
LogP3.04
Rot. Bonds5

About N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide

N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide (PubChem CID 34977030) has the molecular formula C20H18N2O5 and a molecular weight of 366.37 g/mol. Its IUPAC name is N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide.

Molecular Properties

Compound NameN'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide
PubChem CID34977030
Molecular FormulaC20H18N2O5
Molecular Weight366.37 g/mol
Exact Mass366.12
IUPAC NameN'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2occc2-c2ccccc2)cc1OC
InChIInChI=1S/C20H18N2O5/c1-25-16-9-8-14(12-17(16)26-2)19(23)21-22-20(24)18-15(10-11-27-18)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyJWPWZLXZABVIPN-UHFFFAOYSA-N
XLogP3.04
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.37
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-(3-amino-4-methoxybenzoyl)-3,4-diphenylfuran-2-carbohydrazide
CID 68862321
N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide
CID 1210380
N'-(3-methoxy-4-phenylmethoxybenzoyl)-2-methylfuran-3-carbohydrazide
CID 9472683
3,4-dimethoxy-N'-[2-(2-methoxyphenyl)acetyl]benzohydrazide
CID 24645288
N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide
CID 26619016
methyl 3-[[(3,4-dimethoxybenzoyl)amino]carbamoyl]benzoate
CID 17175462
3,4-dimethoxy-N'-(3-phenylpropanoyl)benzohydrazide
CID 1107941
N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide
CID 55996835
3,4-dimethoxy-N'-(2-phenylsulfanylacetyl)benzohydrazide
CID 3283240
3,4-dimethoxy-N-sulfanylbenzamide
CID 71771275
3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide
CID 25443034
N'-(2,2-dimethylpropanoyl)-3,4-dimethoxybenzohydrazide
CID 873947

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide?
The IUPAC name of N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide (CID 34977030) is N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide.
What is the SMILES notation for N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide?
The canonical SMILES for N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide is COc1ccc(C(=O)NNC(=O)c2occc2-c2ccccc2)cc1OC.
What is the InChIKey of N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide?
The InChIKey is JWPWZLXZABVIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O5/c1-25-16-9-8-14(12-17(16)26-2)19(23)21-22-20(24)18-15(10-11-27-18)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide?
N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide has a molecular weight of 366.37 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,4-dimethoxybenzoyl)-3-phenylfuran-2-carbohydrazide is sourced from PubChem (CID 34977030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).