N-benzhydryl-3,5-dimethoxybenzamide

C22H21NO3 — CID 873122

IUPACN-benzhydryl-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)NC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C22H21NO3/c1-25-19-13-18(14-20(15-19)26-2)22(24)23-21(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-15,21H,1-2H3,(H,23,24)
InChIKeyFOGQPQUPSOUSKC-UHFFFAOYSA-N
MW347.41 g/mol
LogP4.22
Rot. Bonds6

About N-benzhydryl-3,5-dimethoxybenzamide

N-benzhydryl-3,5-dimethoxybenzamide (PubChem CID 873122) has the molecular formula C22H21NO3 and a molecular weight of 347.41 g/mol. Its IUPAC name is N-benzhydryl-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-benzhydryl-3,5-dimethoxybenzamide
PubChem CID873122
Molecular FormulaC22H21NO3
Molecular Weight347.41 g/mol
Exact Mass347.15
IUPAC NameN-benzhydryl-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)NC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C22H21NO3/c1-25-19-13-18(14-20(15-19)26-2)22(24)23-21(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-15,21H,1-2H3,(H,23,24)
InChIKeyFOGQPQUPSOUSKC-UHFFFAOYSA-N
XLogP4.22
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.41
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-3,5-dimethoxybenzamide?
The IUPAC name of N-benzhydryl-3,5-dimethoxybenzamide (CID 873122) is N-benzhydryl-3,5-dimethoxybenzamide.
What is the SMILES notation for N-benzhydryl-3,5-dimethoxybenzamide?
The canonical SMILES for N-benzhydryl-3,5-dimethoxybenzamide is COc1cc(OC)cc(C(=O)NC(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of N-benzhydryl-3,5-dimethoxybenzamide?
The InChIKey is FOGQPQUPSOUSKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3/c1-25-19-13-18(14-20(15-19)26-2)22(24)23-21(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-15,21H,1-2H3,(H,23,24).
What are the key properties of N-benzhydryl-3,5-dimethoxybenzamide?
N-benzhydryl-3,5-dimethoxybenzamide has a molecular weight of 347.41 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-3,5-dimethoxybenzamide is sourced from PubChem (CID 873122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).