N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide

C17H24N2O5S — CID 97401229

IUPACN-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide
SMILESCCS(=O)(=O)N1CC2(CCOCC2)c2cc(NC(=O)COC)ccc21
InChIInChI=1S/C17H24N2O5S/c1-3-25(21,22)19-12-17(6-8-24-9-7-17)14-10-13(4-5-15(14)19)18-16(20)11-23-2/h4-5,10H,3,6-9,11-12H2,1-2H3,(H,18,20)
InChIKeyHVPHTELZMXLBLY-UHFFFAOYSA-N
MW368.46 g/mol
LogP1.49
Rot. Bonds5

About N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide

N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide (PubChem CID 97401229) has the molecular formula C17H24N2O5S and a molecular weight of 368.46 g/mol. Its IUPAC name is N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide
PubChem CID97401229
Molecular FormulaC17H24N2O5S
Molecular Weight368.46 g/mol
Exact Mass368.14
IUPAC NameN-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide
SMILESCCS(=O)(=O)N1CC2(CCOCC2)c2cc(NC(=O)COC)ccc21
InChIInChI=1S/C17H24N2O5S/c1-3-25(21,22)19-12-17(6-8-24-9-7-17)14-10-13(4-5-15(14)19)18-16(20)11-23-2/h4-5,10H,3,6-9,11-12H2,1-2H3,(H,18,20)
InChIKeyHVPHTELZMXLBLY-UHFFFAOYSA-N
XLogP1.49
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2-fluoroethyl)spiro[2H-indole-3,4'-oxane]-5-yl]-2-methylpropanamide
CID 97401206
N-(3-chloro-4-piperidin-1-ylphenyl)-2-methoxyacetamide
CID 47296916
N-[4-[1-(2-methylbutanoyl)spiro[2H-indole-3,4'-oxane]-5-yl]phenyl]acetamide
CID 131682351
N-(4-hydrazinylphenyl)-2-methoxyacetamide
CID 141361616
2-methoxy-N-[2-(4-methoxyphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]acetamide
CID 16930520
2-methoxy-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 60656764
N-[1-(cyclopropylmethyl)spiro[2H-indole-3,4'-oxane]-5-yl]-5-methylpyrazolidine-3-carboxamide
CID 134074322
methyl 7-[(2-methoxyacetyl)amino]-3,4-dihydro-1H-isoquinoline-2-carboxylate
CID 121034747
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 43708154
2-methoxy-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-6-yl]acetamide
CID 7656750
2-methoxy-N-[1-(2-methoxyacetyl)-3,4-dihydro-2H-quinolin-7-yl]acetamide
CID 16835177
N-(2-cyclopentyl-1,3-dihydroisoindol-5-yl)-2-methoxyacetamide
CID 110460533

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide?
The IUPAC name of N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide (CID 97401229) is N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide.
What is the SMILES notation for N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide?
The canonical SMILES for N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide is CCS(=O)(=O)N1CC2(CCOCC2)c2cc(NC(=O)COC)ccc21.
What is the InChIKey of N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide?
The InChIKey is HVPHTELZMXLBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O5S/c1-3-25(21,22)19-12-17(6-8-24-9-7-17)14-10-13(4-5-15(14)19)18-16(20)11-23-2/h4-5,10H,3,6-9,11-12H2,1-2H3,(H,18,20).
What are the key properties of N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide?
N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide has a molecular weight of 368.46 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylsulfonylspiro[2H-indole-3,4'-oxane]-5-yl)-2-methoxyacetamide is sourced from PubChem (CID 97401229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).