N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide

C19H26N2O4S — CID 71227478

IUPACN-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
SMILESCOc1ccc2cccc(CCN(C(C)=O)S(=O)(=O)NC(C)(C)C)c2c1
InChIInChI=1S/C19H26N2O4S/c1-14(22)21(26(23,24)20-19(2,3)4)12-11-16-8-6-7-15-9-10-17(25-5)13-18(15)16/h6-10,13,20H,11-12H2,1-5H3
InChIKeyHQMSXPDJFANIPX-UHFFFAOYSA-N
MW378.49 g/mol
LogP2.87
Rot. Bonds6

About N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide

N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide (PubChem CID 71227478) has the molecular formula C19H26N2O4S and a molecular weight of 378.49 g/mol. Its IUPAC name is N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
PubChem CID71227478
Molecular FormulaC19H26N2O4S
Molecular Weight378.49 g/mol
Exact Mass378.16
IUPAC NameN-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
SMILESCOc1ccc2cccc(CCN(C(C)=O)S(=O)(=O)NC(C)(C)C)c2c1
InChIInChI=1S/C19H26N2O4S/c1-14(22)21(26(23,24)20-19(2,3)4)12-11-16-8-6-7-15-9-10-17(25-5)13-18(15)16/h6-10,13,20H,11-12H2,1-5H3
InChIKeyHQMSXPDJFANIPX-UHFFFAOYSA-N
XLogP2.87
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.49
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-bis[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 68534392
N-acetyl-2-amino-N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide
CID 71227732
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;sulfuric acid
CID 71529133
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749
N-[3-(7-methoxynaphthalen-1-yl)propyl]acetamide
CID 10220759
N-tert-butyl-7-methoxynaphthalene-1-sulfonamide
CID 14121039
2-(7-methoxynaphthalen-1-yl)-N-methylethanamine
CID 10104723
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;propanedioic acid
CID 71477284
N-butylsulfonyl-N-[2-(7-methoxynaphthalen-1-yl)ethyl]hexanamide
CID 71227721
N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine
CID 170604527
ethenoxymethanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]-N-methylacetamide
CID 177154324

Frequently Asked Questions

What is the IUPAC name of N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide?
The IUPAC name of N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide (CID 71227478) is N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide.
What is the SMILES notation for N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide?
The canonical SMILES for N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide is COc1ccc2cccc(CCN(C(C)=O)S(=O)(=O)NC(C)(C)C)c2c1.
What is the InChIKey of N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide?
The InChIKey is HQMSXPDJFANIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O4S/c1-14(22)21(26(23,24)20-19(2,3)4)12-11-16-8-6-7-15-9-10-17(25-5)13-18(15)16/h6-10,13,20H,11-12H2,1-5H3.
What are the key properties of N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide?
N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide has a molecular weight of 378.49 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide is sourced from PubChem (CID 71227478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).