2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate

C19H14NO3- — CID 2405590

IUPAC2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate
SMILESO=C(Cc1ccccc1C(=O)[O-])Nc1cccc2ccccc12
InChIInChI=1S/C19H15NO3/c21-18(12-14-7-2-4-10-16(14)19(22)23)20-17-11-5-8-13-6-1-3-9-15(13)17/h1-11H,12H2,(H,20,21)(H,22,23)/p-1
InChIKeyFARAKKYGWGWSNL-UHFFFAOYSA-M
MW304.33 g/mol
LogP2.38
Rot. Bonds4

About 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate

2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate (PubChem CID 2405590) has the molecular formula C19H14NO3- and a molecular weight of 304.33 g/mol. Its IUPAC name is 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate.

Molecular Properties

Compound Name2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate
PubChem CID2405590
Molecular FormulaC19H14NO3-
Molecular Weight304.33 g/mol
Exact Mass304.10
IUPAC Name2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate
SMILESO=C(Cc1ccccc1C(=O)[O-])Nc1cccc2ccccc12
InChIInChI=1S/C19H15NO3/c21-18(12-14-7-2-4-10-16(14)19(22)23)20-17-11-5-8-13-6-1-3-9-15(13)17/h1-11H,12H2,(H,20,21)(H,22,23)/p-1
InChIKeyFARAKKYGWGWSNL-UHFFFAOYSA-M
XLogP2.38
TPSA69.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-[[2-[(2-naphthalen-1-ylacetyl)amino]benzoyl]amino]acetic acid
CID 134594660
N-naphthalen-1-yl-2-naphthalen-2-ylacetamide
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N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228165
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
2-[2-(isoquinolin-8-ylamino)-2-oxoethyl]benzoic acid
CID 11779892
3-fluoro-N-naphthalen-1-ylpropanamide
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CID 27185701

Frequently Asked Questions

What is the IUPAC name of 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate?
The IUPAC name of 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate (CID 2405590) is 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate.
What is the SMILES notation for 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate?
The canonical SMILES for 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate is O=C(Cc1ccccc1C(=O)[O-])Nc1cccc2ccccc12.
What is the InChIKey of 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate?
The InChIKey is FARAKKYGWGWSNL-UHFFFAOYSA-M. The full InChI is InChI=1S/C19H15NO3/c21-18(12-14-7-2-4-10-16(14)19(22)23)20-17-11-5-8-13-6-1-3-9-15(13)17/h1-11H,12H2,(H,20,21)(H,22,23)/p-1.
What are the key properties of 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate?
2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate has a molecular weight of 304.33 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzoate is sourced from PubChem (CID 2405590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).