N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide

C24H19NO2 — CID 1190439

IUPACN-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)c2ccccc12
InChIInChI=1S/C24H19NO2/c1-27-23-16-15-22(20-9-5-6-10-21(20)23)25-24(26)19-13-11-18(12-14-19)17-7-3-2-4-8-17/h2-16H,1H3,(H,25,26)
InChIKeyTZQZSQGXGVMWTN-UHFFFAOYSA-N
MW353.42 g/mol
LogP5.77
Rot. Bonds4

About N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide

N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide (PubChem CID 1190439) has the molecular formula C24H19NO2 and a molecular weight of 353.42 g/mol. Its IUPAC name is N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide.

Molecular Properties

Compound NameN-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide
PubChem CID1190439
Molecular FormulaC24H19NO2
Molecular Weight353.42 g/mol
Exact Mass353.14
IUPAC NameN-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)c2ccccc12
InChIInChI=1S/C24H19NO2/c1-27-23-16-15-22(20-9-5-6-10-21(20)23)25-24(26)19-13-11-18(12-14-19)17-7-3-2-4-8-17/h2-16H,1H3,(H,25,26)
InChIKeyTZQZSQGXGVMWTN-UHFFFAOYSA-N
XLogP5.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.42
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide?
The IUPAC name of N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide (CID 1190439) is N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide.
What is the SMILES notation for N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide?
The canonical SMILES for N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide is COc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)c2ccccc12.
What is the InChIKey of N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide?
The InChIKey is TZQZSQGXGVMWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO2/c1-27-23-16-15-22(20-9-5-6-10-21(20)23)25-24(26)19-13-11-18(12-14-19)17-7-3-2-4-8-17/h2-16H,1H3,(H,25,26).
What are the key properties of N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide?
N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide has a molecular weight of 353.42 g/mol, XLogP of 5.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxynaphthalen-1-yl)-4-phenylbenzamide is sourced from PubChem (CID 1190439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).