4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide

C24H18N2O2 — CID 170421596

IUPAC4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide
SMILESCC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc4ccccc34)cc2)nc1
InChIInChI=1S/C24H18N2O2/c1-16(27)20-13-14-22(25-15-20)18-9-11-19(12-10-18)24(28)26-23-8-4-6-17-5-2-3-7-21(17)23/h2-15H,1H3,(H,26,28)
InChIKeyMXCKAWOISSHGPE-UHFFFAOYSA-N
MW366.42 g/mol
LogP5.36
Rot. Bonds4

About 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide

4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide (PubChem CID 170421596) has the molecular formula C24H18N2O2 and a molecular weight of 366.42 g/mol. Its IUPAC name is 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound Name4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide
PubChem CID170421596
Molecular FormulaC24H18N2O2
Molecular Weight366.42 g/mol
Exact Mass366.14
IUPAC Name4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide
SMILESCC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc4ccccc34)cc2)nc1
InChIInChI=1S/C24H18N2O2/c1-16(27)20-13-14-22(25-15-20)18-9-11-19(12-10-18)24(28)26-23-8-4-6-17-5-2-3-7-21(17)23/h2-15H,1H3,(H,26,28)
InChIKeyMXCKAWOISSHGPE-UHFFFAOYSA-N
XLogP5.36
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.42
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-acetylphenyl)-N-naphthalen-1-ylbenzamide
CID 170421600
N-naphthalen-1-yl-4-sulfanylbenzamide
CID 107019782
6-[4-(naphthalene-1-carbonylamino)phenyl]-N-phenylpyridine-3-carboxamide
CID 170421908
N-[6-(4-benzamidophenyl)-3-pyridinyl]naphthalene-1-carboxamide
CID 170422622
3-(5-acetyl-2-pyridinyl)-5-fluoro-N-quinolin-5-ylbenzamide;formic acid
CID 171339257
N-naphthalen-1-yl-4-propan-2-ylsulfonylbenzamide
CID 41148682
1-[6-[4-(hydroxymethyl)phenyl]-3-pyridinyl]ethanone
CID 39773387
N-naphthalen-1-ylpyridine-3-carboxamide
CID 532824
4-(5-methyltriazol-1-yl)-N-naphthalen-1-ylbenzamide
CID 16648879
4-[(4-bromobenzoyl)amino]-N-naphthalen-1-ylbenzamide
CID 1215843
4-heptoxy-N-naphthalen-1-ylbenzamide
CID 4950571
6-[4-(naphthalen-2-ylcarbamoyl)phenyl]-N-phenylpyridine-3-carboxamide
CID 170421562

Frequently Asked Questions

What is the IUPAC name of 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide?
The IUPAC name of 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide (CID 170421596) is 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide?
The canonical SMILES for 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide is CC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc4ccccc34)cc2)nc1.
What is the InChIKey of 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide?
The InChIKey is MXCKAWOISSHGPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O2/c1-16(27)20-13-14-22(25-15-20)18-9-11-19(12-10-18)24(28)26-23-8-4-6-17-5-2-3-7-21(17)23/h2-15H,1H3,(H,26,28).
What are the key properties of 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide?
4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide has a molecular weight of 366.42 g/mol, XLogP of 5.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-acetyl-2-pyridinyl)-N-naphthalen-1-ylbenzamide is sourced from PubChem (CID 170421596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).