2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide

C16H17BrN2O3 — CID 9231222

IUPAC2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide
SMILESCCNC(=O)CNC(=O)COc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H17BrN2O3/c1-2-18-15(20)9-19-16(21)10-22-14-6-4-11-7-13(17)5-3-12(11)8-14/h3-8H,2,9-10H2,1H3,(H,18,20)(H,19,21)
InChIKeyRIJOBRBFTYGOEL-UHFFFAOYSA-N
MW365.23 g/mol
LogP2.23
Rot. Bonds6

About 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide

2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide (PubChem CID 9231222) has the molecular formula C16H17BrN2O3 and a molecular weight of 365.23 g/mol. Its IUPAC name is 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide
PubChem CID9231222
Molecular FormulaC16H17BrN2O3
Molecular Weight365.23 g/mol
Exact Mass364.04
IUPAC Name2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide
SMILESCCNC(=O)CNC(=O)COc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H17BrN2O3/c1-2-18-15(20)9-19-16(21)10-22-14-6-4-11-7-13(17)5-3-12(11)8-14/h3-8H,2,9-10H2,1H3,(H,18,20)(H,19,21)
InChIKeyRIJOBRBFTYGOEL-UHFFFAOYSA-N
XLogP2.23
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.23
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-bromonaphthalen-2-yl)oxy-N-(2-methylpropyl)acetamide
CID 3989542
N-ethyl-2-[[2-(4-iodophenoxy)acetyl]amino]acetamide
CID 9076404
N-ethyl-2-[[2-(4-propoxyphenoxy)acetyl]amino]acetamide
CID 86907761
N-(3-amino-2-methylpropyl)-2-(6-bromonaphthalen-2-yl)oxyacetamide
CID 119996539
2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide
CID 7786804
2-(6-bromonaphthalen-2-yl)oxy-N-[(4-chlorophenyl)methyl]acetamide
CID 7786789
N-(2-methoxyethyl)-2-[(2-naphthalen-2-yloxyacetyl)amino]acetamide
CID 24517119
2-(6-bromonaphthalen-2-yl)oxy-N-[4-(diethylamino)phenyl]acetamide
CID 3872632
2-(6-bromonaphthalen-2-yl)oxy-N-[(2-ethoxy-3-pyridinyl)methyl]acetamide
CID 55774453
2-(6-bromonaphthalen-2-yl)oxy-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 9231224
2-[(2-naphthalen-2-yloxyacetyl)amino]-N-propan-2-ylacetamide
CID 17479065
2-(6-bromonaphthalen-2-yl)oxy-N-naphthalen-2-ylacetamide
CID 7786811

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide?
The IUPAC name of 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide (CID 9231222) is 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide.
What is the SMILES notation for 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide?
The canonical SMILES for 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide is CCNC(=O)CNC(=O)COc1ccc2cc(Br)ccc2c1.
What is the InChIKey of 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide?
The InChIKey is RIJOBRBFTYGOEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17BrN2O3/c1-2-18-15(20)9-19-16(21)10-22-14-6-4-11-7-13(17)5-3-12(11)8-14/h3-8H,2,9-10H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide?
2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide has a molecular weight of 365.23 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide is sourced from PubChem (CID 9231222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).