2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide

C16H18BrNO2 — CID 60517133

IUPAC2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)Oc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H18BrNO2/c1-10(2)18-16(19)11(3)20-15-7-5-12-8-14(17)6-4-13(12)9-15/h4-11H,1-3H3,(H,18,19)
InChIKeyZWXHYNXOJOGUAD-UHFFFAOYSA-N
MW336.23 g/mol
LogP3.89
Rot. Bonds4

About 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide

2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide (PubChem CID 60517133) has the molecular formula C16H18BrNO2 and a molecular weight of 336.23 g/mol. Its IUPAC name is 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide
PubChem CID60517133
Molecular FormulaC16H18BrNO2
Molecular Weight336.23 g/mol
Exact Mass335.05
IUPAC Name2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)Oc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H18BrNO2/c1-10(2)18-16(19)11(3)20-15-7-5-12-8-14(17)6-4-13(12)9-15/h4-11H,1-3H3,(H,18,19)
InChIKeyZWXHYNXOJOGUAD-UHFFFAOYSA-N
XLogP3.89
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.23
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(6-bromonaphthalen-2-yl)oxy-N-[(1R)-1-(4-fluorophenyl)ethyl]propanamide
CID 7786780
3-(6-bromonaphthalen-2-yl)oxybutan-2-one
CID 60624745
(6-bromonaphthalen-2-yl) N-propan-2-ylcarbamate
CID 3678098
2-(6-bromonaphthalen-2-yl)oxypropanoyl chloride
CID 10380881
ethyl (2S)-2-(6-bromonaphthalen-2-yl)oxypropanoate
CID 57054525
2-(3,4-dichlorophenoxy)-N-propan-2-ylpropanamide
CID 47109802
1-(4-acetylpiperazin-1-yl)-2-(6-bromonaphthalen-2-yl)oxypropan-1-one
CID 78841438
(2R)-2-(6-bromonaphthalen-2-yl)oxy-1-piperidin-1-ylpropan-1-one
CID 7916276
(2R)-2-(4-fluorophenoxy)-N-propan-2-ylpropanamide
CID 94335659
2-[2-(4-bromophenoxy)propanoylamino]propanoic acid
CID 18837935
2-(4-tert-butylphenoxy)-N-propan-2-ylpropanamide
CID 16620513
2-(3-amino-4-methylphenoxy)-N-propan-2-ylpropanamide
CID 114252443

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide?
The IUPAC name of 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide (CID 60517133) is 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)Oc1ccc2cc(Br)ccc2c1.
What is the InChIKey of 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide?
The InChIKey is ZWXHYNXOJOGUAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrNO2/c1-10(2)18-16(19)11(3)20-15-7-5-12-8-14(17)6-4-13(12)9-15/h4-11H,1-3H3,(H,18,19).
What are the key properties of 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide?
2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide has a molecular weight of 336.23 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide is sourced from PubChem (CID 60517133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).