2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide

C20H21N3O3S — CID 45375642

IUPAC2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide
SMILESCCN(CC(=O)NCc1ccccn1)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H21N3O3S/c1-2-23(15-20(24)22-14-18-9-5-6-12-21-18)27(25,26)19-11-10-16-7-3-4-8-17(16)13-19/h3-13H,2,14-15H2,1H3,(H,22,24)
InChIKeyQDOSFKVMYNIUPV-UHFFFAOYSA-N
MW383.47 g/mol
LogP2.56
Rot. Bonds7

About 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide

2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 45375642) has the molecular formula C20H21N3O3S and a molecular weight of 383.47 g/mol. Its IUPAC name is 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide
PubChem CID45375642
Molecular FormulaC20H21N3O3S
Molecular Weight383.47 g/mol
Exact Mass383.13
IUPAC Name2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide
SMILESCCN(CC(=O)NCc1ccccn1)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C20H21N3O3S/c1-2-23(15-20(24)22-14-18-9-5-6-12-21-18)27(25,26)19-11-10-16-7-3-4-8-17(16)13-19/h3-13H,2,14-15H2,1H3,(H,22,24)
InChIKeyQDOSFKVMYNIUPV-UHFFFAOYSA-N
XLogP2.56
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-hydroxy-2-[naphthalen-2-ylsulfonyl(pyridin-2-ylmethyl)amino]acetamide
CID 91027075
2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 2878917
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide
CID 3485774
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-[(2S)-pentan-2-yl]acetamide
CID 92518793
2-[(4-ethoxyphenyl)sulfonyl-methylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 3163372
N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 1243481
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 2980569
N-(3-bromophenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2234331
2-[(4-bromophenyl)sulfonyl-(2-phenylethyl)amino]-N-(pyridin-2-ylmethyl)acetamide
CID 1120654
2-[3-(dimethylamino)propyl-methylsulfonylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 113150116
N-ethyl-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 27276320
2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-ethoxyanilino)-N-(pyridin-2-ylmethyl)acetamide
CID 1076312

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide (CID 45375642) is 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide is CCN(CC(=O)NCc1ccccn1)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is QDOSFKVMYNIUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3S/c1-2-23(15-20(24)22-14-18-9-5-6-12-21-18)27(25,26)19-11-10-16-7-3-4-8-17(16)13-19/h3-13H,2,14-15H2,1H3,(H,22,24).
What are the key properties of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide?
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 383.47 g/mol, XLogP of 2.56, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 45375642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).