3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide

C19H16BrNO2 — CID 19174691

IUPAC3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide
SMILESO=C(NCCOc1cccc2ccccc12)c1cccc(Br)c1
InChIInChI=1S/C19H16BrNO2/c20-16-8-3-7-15(13-16)19(22)21-11-12-23-18-10-4-6-14-5-1-2-9-17(14)18/h1-10,13H,11-12H2,(H,21,22)
InChIKeyCSNNLHBDWQVRNJ-UHFFFAOYSA-N
MW370.25 g/mol
LogP4.41
Rot. Bonds5

About 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide

3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide (PubChem CID 19174691) has the molecular formula C19H16BrNO2 and a molecular weight of 370.25 g/mol. Its IUPAC name is 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide.

Molecular Properties

Compound Name3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide
PubChem CID19174691
Molecular FormulaC19H16BrNO2
Molecular Weight370.25 g/mol
Exact Mass369.04
IUPAC Name3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide
SMILESO=C(NCCOc1cccc2ccccc12)c1cccc(Br)c1
InChIInChI=1S/C19H16BrNO2/c20-16-8-3-7-15(13-16)19(22)21-11-12-23-18-10-4-6-14-5-1-2-9-17(14)18/h1-10,13H,11-12H2,(H,21,22)
InChIKeyCSNNLHBDWQVRNJ-UHFFFAOYSA-N
XLogP4.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.25
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-methoxy-N-(2-naphthalen-1-yloxyethyl)benzamide
CID 19174692
3-(methanesulfonamido)-N-(2-naphthalen-1-yloxyethyl)benzamide
CID 94559214
3-bromo-N-[2-(2,3-dimethylphenoxy)ethyl]benzamide
CID 113100932
3,4,5-trimethoxy-N-(2-naphthalen-1-yloxyethyl)benzamide
CID 19174588
N-[2-[(3-bromobenzoyl)amino]ethyl]naphthalene-1-carboxamide
CID 108539666
3-[(2-methylcyclopropanecarbonyl)amino]-N-(2-naphthalen-1-yloxyethyl)benzamide
CID 55863094
3-bromo-N-[2-(4-methoxyphenoxy)ethyl]benzamide
CID 27173443
5-bromo-N-(2-naphthalen-1-yloxyethyl)thiophene-2-carboxamide
CID 55889774
N-(2-naphthalen-1-yloxyethyl)-1H-pyrazole-5-carboxamide
CID 71939309
3-bromo-N-[[1-(3-naphthalen-1-yloxypropyl)benzimidazol-2-yl]methyl]benzamide
CID 17008150
2-chloro-N-(2-naphthalen-1-yloxyethyl)benzamide
CID 19174581
2-[(3-bromobenzoyl)amino]ethyl carbamate
CID 83203374

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide?
The IUPAC name of 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide (CID 19174691) is 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide.
What is the SMILES notation for 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide?
The canonical SMILES for 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide is O=C(NCCOc1cccc2ccccc12)c1cccc(Br)c1.
What is the InChIKey of 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide?
The InChIKey is CSNNLHBDWQVRNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrNO2/c20-16-8-3-7-15(13-16)19(22)21-11-12-23-18-10-4-6-14-5-1-2-9-17(14)18/h1-10,13H,11-12H2,(H,21,22).
What are the key properties of 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide?
3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide has a molecular weight of 370.25 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(2-naphthalen-1-yloxyethyl)benzamide is sourced from PubChem (CID 19174691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).