3-benzamido-N-(4-bromophenyl)benzamide

C20H15BrN2O2 — CID 1306656

IUPAC3-benzamido-N-(4-bromophenyl)benzamide
SMILESO=C(Nc1cccc(C(=O)Nc2ccc(Br)cc2)c1)c1ccccc1
InChIInChI=1S/C20H15BrN2O2/c21-16-9-11-17(12-10-16)22-20(25)15-7-4-8-18(13-15)23-19(24)14-5-2-1-3-6-14/h1-13H,(H,22,25)(H,23,24)
InChIKeyRONSRWCCLPNVLQ-UHFFFAOYSA-N
MW395.26 g/mol
LogP4.95
Rot. Bonds4

About 3-benzamido-N-(4-bromophenyl)benzamide

3-benzamido-N-(4-bromophenyl)benzamide (PubChem CID 1306656) has the molecular formula C20H15BrN2O2 and a molecular weight of 395.26 g/mol. Its IUPAC name is 3-benzamido-N-(4-bromophenyl)benzamide.

Molecular Properties

Compound Name3-benzamido-N-(4-bromophenyl)benzamide
PubChem CID1306656
Molecular FormulaC20H15BrN2O2
Molecular Weight395.26 g/mol
Exact Mass394.03
IUPAC Name3-benzamido-N-(4-bromophenyl)benzamide
SMILESO=C(Nc1cccc(C(=O)Nc2ccc(Br)cc2)c1)c1ccccc1
InChIInChI=1S/C20H15BrN2O2/c21-16-9-11-17(12-10-16)22-20(25)15-7-4-8-18(13-15)23-19(24)14-5-2-1-3-6-14/h1-13H,(H,22,25)(H,23,24)
InChIKeyRONSRWCCLPNVLQ-UHFFFAOYSA-N
XLogP4.95
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.26
LogP ≤ 54.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(4-bromophenyl)benzamide?
The IUPAC name of 3-benzamido-N-(4-bromophenyl)benzamide (CID 1306656) is 3-benzamido-N-(4-bromophenyl)benzamide.
What is the SMILES notation for 3-benzamido-N-(4-bromophenyl)benzamide?
The canonical SMILES for 3-benzamido-N-(4-bromophenyl)benzamide is O=C(Nc1cccc(C(=O)Nc2ccc(Br)cc2)c1)c1ccccc1.
What is the InChIKey of 3-benzamido-N-(4-bromophenyl)benzamide?
The InChIKey is RONSRWCCLPNVLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15BrN2O2/c21-16-9-11-17(12-10-16)22-20(25)15-7-4-8-18(13-15)23-19(24)14-5-2-1-3-6-14/h1-13H,(H,22,25)(H,23,24).
What are the key properties of 3-benzamido-N-(4-bromophenyl)benzamide?
3-benzamido-N-(4-bromophenyl)benzamide has a molecular weight of 395.26 g/mol, XLogP of 4.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-(4-bromophenyl)benzamide is sourced from PubChem (CID 1306656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).