2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide

C22H26N2O4S — CID 18190586

IUPAC2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCCCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)C1=Cc2ccccc2CC1
InChIInChI=1S/C22H26N2O4S/c1-3-14-24(16-22(25)23-20-10-6-7-11-21(20)28-2)29(26,27)19-13-12-17-8-4-5-9-18(17)15-19/h4-11,15H,3,12-14,16H2,1-2H3,(H,23,25)
InChIKeyUDHDVTXAFPBPFL-UHFFFAOYSA-N
MW414.53 g/mol
LogP3.66
Rot. Bonds8

About 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide

2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide (PubChem CID 18190586) has the molecular formula C22H26N2O4S and a molecular weight of 414.53 g/mol. Its IUPAC name is 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide
PubChem CID18190586
Molecular FormulaC22H26N2O4S
Molecular Weight414.53 g/mol
Exact Mass414.16
IUPAC Name2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCCCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)C1=Cc2ccccc2CC1
InChIInChI=1S/C22H26N2O4S/c1-3-14-24(16-22(25)23-20-10-6-7-11-21(20)28-2)29(26,27)19-13-12-17-8-4-5-9-18(17)15-19/h4-11,15H,3,12-14,16H2,1-2H3,(H,23,25)
InChIKeyUDHDVTXAFPBPFL-UHFFFAOYSA-N
XLogP3.66
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.53
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]acetate
CID 52599748
2-[(3,4-dimethoxyphenyl)sulfonyl-propylamino]-N-(2-methoxyphenyl)acetamide
CID 40682573
2-[(3-bromo-4-methoxyphenyl)sulfonyl-propylamino]-N-(2-methoxyphenyl)acetamide
CID 30329804
2-[butyl(methyl)amino]-N-(2-methoxyphenyl)acetamide
CID 109006138
2-[[4-fluoro-3-(trifluoromethyl)phenyl]sulfonyl-propylamino]-N-(2-methoxyphenyl)acetamide
CID 52746584
4-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylbutanamide
CID 119267716
N-(2-methoxyphenyl)-2-[(8-methylquinolin-5-yl)sulfonyl-propylamino]acetamide
CID 46634659
2-[hexyl(propyl)amino]-N-(2-methoxyphenyl)acetamide
CID 78820994
2-[2-methoxyethyl(methylsulfonyl)amino]-N-(2-methoxyphenyl)acetamide
CID 113149350
2-amino-N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propylacetamide
CID 119267704
N-[2-(2-methoxyanilino)-2-oxoethyl]-N-propyl-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 55559572
2-[azetidin-3-yl(propyl)amino]-N-(2-methoxyphenyl)acetamide
CID 66216109

Frequently Asked Questions

What is the IUPAC name of 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide (CID 18190586) is 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide is CCCN(CC(=O)Nc1ccccc1OC)S(=O)(=O)C1=Cc2ccccc2CC1.
What is the InChIKey of 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is UDHDVTXAFPBPFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4S/c1-3-14-24(16-22(25)23-20-10-6-7-11-21(20)28-2)29(26,27)19-13-12-17-8-4-5-9-18(17)15-19/h4-11,15H,3,12-14,16H2,1-2H3,(H,23,25).
What are the key properties of 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide?
2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 414.53 g/mol, XLogP of 3.66, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3,4-dihydronaphthalen-2-ylsulfonyl(propyl)amino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 18190586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).