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

C20H15BrN2O2 — CID 1304486

IUPAC3-benzamido-N-(3-bromophenyl)benzamide
SMILESO=C(Nc1cccc(C(=O)Nc2cccc(Br)c2)c1)c1ccccc1
InChIInChI=1S/C20H15BrN2O2/c21-16-9-5-11-18(13-16)23-20(25)15-8-4-10-17(12-15)22-19(24)14-6-2-1-3-7-14/h1-13H,(H,22,24)(H,23,25)
InChIKeyKQDXJBHXCKKGDR-UHFFFAOYSA-N
MW395.26 g/mol
LogP4.95
Rot. Bonds4

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

3-benzamido-N-(3-bromophenyl)benzamide (PubChem CID 1304486) has the molecular formula C20H15BrN2O2 and a molecular weight of 395.26 g/mol. Its IUPAC name is 3-benzamido-N-(3-bromophenyl)benzamide.

Molecular Properties

Compound Name3-benzamido-N-(3-bromophenyl)benzamide
PubChem CID1304486
Molecular FormulaC20H15BrN2O2
Molecular Weight395.26 g/mol
Exact Mass394.03
IUPAC Name3-benzamido-N-(3-bromophenyl)benzamide
SMILESO=C(Nc1cccc(C(=O)Nc2cccc(Br)c2)c1)c1ccccc1
InChIInChI=1S/C20H15BrN2O2/c21-16-9-5-11-18(13-16)23-20(25)15-8-4-10-17(12-15)22-19(24)14-6-2-1-3-7-14/h1-13H,(H,22,24)(H,23,25)
InChIKeyKQDXJBHXCKKGDR-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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Related Compounds

4-N-(3-bromophenyl)benzene-1,4-dicarboxamide
CID 30844565
N-[3-[[2-(3-bromoanilino)acetyl]amino]phenyl]benzamide
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3-bromo-N-[3-[(2-phenylacetyl)amino]phenyl]benzamide
CID 54790995
N-(3-bromophenyl)-3-(cyclopropanecarbonylamino)benzamide
CID 35436954
N-(3-bromophenyl)-4-carbamothioylbenzamide
CID 24708303
N-hydroxy-3-[(4-phenylbenzoyl)amino]benzamide
CID 142750431
2-[(3-bromobenzoyl)amino]-N-phenylbenzamide
CID 54790950
4-(benzenesulfonamido)-N-(3-bromophenyl)benzamide
CID 24643343
2-benzamido-N-(3-bromophenyl)-1,3-oxazole-4-carboxamide
CID 90514961
N-benzoyl-3-bromobenzamide
CID 118577200
N-(3-bromophenyl)-3,5-difluorobenzamide
CID 3660841
3-bromo-N-pyridin-4-ylbenzamide
CID 4130300

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-(3-bromophenyl)benzamide?
The IUPAC name of 3-benzamido-N-(3-bromophenyl)benzamide (CID 1304486) is 3-benzamido-N-(3-bromophenyl)benzamide.
What is the SMILES notation for 3-benzamido-N-(3-bromophenyl)benzamide?
The canonical SMILES for 3-benzamido-N-(3-bromophenyl)benzamide is O=C(Nc1cccc(C(=O)Nc2cccc(Br)c2)c1)c1ccccc1.
What is the InChIKey of 3-benzamido-N-(3-bromophenyl)benzamide?
The InChIKey is KQDXJBHXCKKGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15BrN2O2/c21-16-9-5-11-18(13-16)23-20(25)15-8-4-10-17(12-15)22-19(24)14-6-2-1-3-7-14/h1-13H,(H,22,24)(H,23,25).
What are the key properties of 3-benzamido-N-(3-bromophenyl)benzamide?
3-benzamido-N-(3-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-(3-bromophenyl)benzamide is sourced from PubChem (CID 1304486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).