N',N'-dibenzyl-1-benzofuran-2-carbohydrazide

C23H20N2O2 — CID 9293807

IUPACN',N'-dibenzyl-1-benzofuran-2-carbohydrazide
SMILESO=C(NN(Cc1ccccc1)Cc1ccccc1)c1cc2ccccc2o1
InChIInChI=1S/C23H20N2O2/c26-23(22-15-20-13-7-8-14-21(20)27-22)24-25(16-18-9-3-1-4-10-18)17-19-11-5-2-6-12-19/h1-15H,16-17H2,(H,24,26)
InChIKeyOWYHWIHMZNWNFJ-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.78
Rot. Bonds6

About N',N'-dibenzyl-1-benzofuran-2-carbohydrazide

N',N'-dibenzyl-1-benzofuran-2-carbohydrazide (PubChem CID 9293807) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is N',N'-dibenzyl-1-benzofuran-2-carbohydrazide.

Molecular Properties

Compound NameN',N'-dibenzyl-1-benzofuran-2-carbohydrazide
PubChem CID9293807
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC NameN',N'-dibenzyl-1-benzofuran-2-carbohydrazide
SMILESO=C(NN(Cc1ccccc1)Cc1ccccc1)c1cc2ccccc2o1
InChIInChI=1S/C23H20N2O2/c26-23(22-15-20-13-7-8-14-21(20)27-22)24-25(16-18-9-3-1-4-10-18)17-19-11-5-2-6-12-19/h1-15H,16-17H2,(H,24,26)
InChIKeyOWYHWIHMZNWNFJ-UHFFFAOYSA-N
XLogP4.78
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N',N'-dibenzyl-2-oxochromene-3-carbohydrazide
CID 9293863
N-benzyl-N-ethyl-1-benzofuran-2-carboxamide
CID 110698803
N-(3-iodopropyl)-1-benzofuran-2-carboxamide
CID 114504013
N-benzhydryl-1-benzofuran-2-carboxamide
CID 880613
N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 86994462
N-tert-butyl-1-benzofuran-2-carboxamide
CID 737735
2-(1-benzofuran-2-carbonylamino)-2-methylpropanoic acid
CID 61262055
N-(2-methylbutan-2-yl)-1-benzofuran-2-carboxamide
CID 40623926
N-prop-2-ynyl-1-benzofuran-2-carboxamide
CID 60646228
N-[(2S)-2-amino-2-phenylethyl]-1-benzofuran-2-carboxamide
CID 150997977
1-(1-benzofuran-2-carbonylamino)-3-(3-methoxypropyl)-1-methylthiourea
CID 9329159
N'-tert-butyl-N'-(3,5-dimethylbenzoyl)-1-benzofuran-2-carbohydrazide
CID 59992458

Frequently Asked Questions

What is the IUPAC name of N',N'-dibenzyl-1-benzofuran-2-carbohydrazide?
The IUPAC name of N',N'-dibenzyl-1-benzofuran-2-carbohydrazide (CID 9293807) is N',N'-dibenzyl-1-benzofuran-2-carbohydrazide.
What is the SMILES notation for N',N'-dibenzyl-1-benzofuran-2-carbohydrazide?
The canonical SMILES for N',N'-dibenzyl-1-benzofuran-2-carbohydrazide is O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cc2ccccc2o1.
What is the InChIKey of N',N'-dibenzyl-1-benzofuran-2-carbohydrazide?
The InChIKey is OWYHWIHMZNWNFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c26-23(22-15-20-13-7-8-14-21(20)27-22)24-25(16-18-9-3-1-4-10-18)17-19-11-5-2-6-12-19/h1-15H,16-17H2,(H,24,26).
What are the key properties of N',N'-dibenzyl-1-benzofuran-2-carbohydrazide?
N',N'-dibenzyl-1-benzofuran-2-carbohydrazide has a molecular weight of 356.43 g/mol, XLogP of 4.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dibenzyl-1-benzofuran-2-carbohydrazide is sourced from PubChem (CID 9293807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).