3-methyl-N-naphthalen-2-ylbenzamide

C18H15NO — CID 687041

IUPAC3-methyl-N-naphthalen-2-ylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc3ccccc3c2)c1
InChIInChI=1S/C18H15NO/c1-13-5-4-8-16(11-13)18(20)19-17-10-9-14-6-2-3-7-15(14)12-17/h2-12H,1H3,(H,19,20)
InChIKeyIOXWBQKQLRXZJG-UHFFFAOYSA-N
MW261.32 g/mol
LogP4.40
Rot. Bonds2

About 3-methyl-N-naphthalen-2-ylbenzamide

3-methyl-N-naphthalen-2-ylbenzamide (PubChem CID 687041) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-methyl-N-naphthalen-2-ylbenzamide.

Molecular Properties

Compound Name3-methyl-N-naphthalen-2-ylbenzamide
PubChem CID687041
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name3-methyl-N-naphthalen-2-ylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc3ccccc3c2)c1
InChIInChI=1S/C18H15NO/c1-13-5-4-8-16(11-13)18(20)19-17-10-9-14-6-2-3-7-15(14)12-17/h2-12H,1H3,(H,19,20)
InChIKeyIOXWBQKQLRXZJG-UHFFFAOYSA-N
XLogP4.40
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-naphthalen-2-ylbenzamide?
The IUPAC name of 3-methyl-N-naphthalen-2-ylbenzamide (CID 687041) is 3-methyl-N-naphthalen-2-ylbenzamide.
What is the SMILES notation for 3-methyl-N-naphthalen-2-ylbenzamide?
The canonical SMILES for 3-methyl-N-naphthalen-2-ylbenzamide is Cc1cccc(C(=O)Nc2ccc3ccccc3c2)c1.
What is the InChIKey of 3-methyl-N-naphthalen-2-ylbenzamide?
The InChIKey is IOXWBQKQLRXZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO/c1-13-5-4-8-16(11-13)18(20)19-17-10-9-14-6-2-3-7-15(14)12-17/h2-12H,1H3,(H,19,20).
What are the key properties of 3-methyl-N-naphthalen-2-ylbenzamide?
3-methyl-N-naphthalen-2-ylbenzamide has a molecular weight of 261.32 g/mol, XLogP of 4.40, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-naphthalen-2-ylbenzamide is sourced from PubChem (CID 687041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).