N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide

C19H16BrNO2 — CID 1325558

IUPACN-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide
SMILESCc1cc(Br)ccc1NC(=O)COc1cccc2ccccc12
InChIInChI=1S/C19H16BrNO2/c1-13-11-15(20)9-10-17(13)21-19(22)12-23-18-8-4-6-14-5-2-3-7-16(14)18/h2-11H,12H2,1H3,(H,21,22)
InChIKeyFNUSTCRDXIOMCH-UHFFFAOYSA-N
MW370.25 g/mol
LogP4.93
Rot. Bonds4

About N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide

N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide (PubChem CID 1325558) has the molecular formula C19H16BrNO2 and a molecular weight of 370.25 g/mol. Its IUPAC name is N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide.

Molecular Properties

Compound NameN-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide
PubChem CID1325558
Molecular FormulaC19H16BrNO2
Molecular Weight370.25 g/mol
Exact Mass369.04
IUPAC NameN-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide
SMILESCc1cc(Br)ccc1NC(=O)COc1cccc2ccccc12
InChIInChI=1S/C19H16BrNO2/c1-13-11-15(20)9-10-17(13)21-19(22)12-23-18-8-4-6-14-5-2-3-7-16(14)18/h2-11H,12H2,1H3,(H,21,22)
InChIKeyFNUSTCRDXIOMCH-UHFFFAOYSA-N
XLogP4.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.25
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide?
The IUPAC name of N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide (CID 1325558) is N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide.
What is the SMILES notation for N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide?
The canonical SMILES for N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide is Cc1cc(Br)ccc1NC(=O)COc1cccc2ccccc12.
What is the InChIKey of N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide?
The InChIKey is FNUSTCRDXIOMCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrNO2/c1-13-11-15(20)9-10-17(13)21-19(22)12-23-18-8-4-6-14-5-2-3-7-16(14)18/h2-11H,12H2,1H3,(H,21,22).
What are the key properties of N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide?
N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide has a molecular weight of 370.25 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide is sourced from PubChem (CID 1325558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).