N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide

C19H21NO4S — CID 42773342

IUPACN-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide
SMILESCOCCN(Cc1ccc(C)o1)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H21NO4S/c1-15-7-9-18(24-15)14-20(11-12-23-2)25(21,22)19-10-8-16-5-3-4-6-17(16)13-19/h3-10,13H,11-12,14H2,1-2H3
InChIKeyPBOBQHVGDKLWSC-UHFFFAOYSA-N
MW359.45 g/mol
LogP3.58
Rot. Bonds7

About N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide

N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide (PubChem CID 42773342) has the molecular formula C19H21NO4S and a molecular weight of 359.45 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide
PubChem CID42773342
Molecular FormulaC19H21NO4S
Molecular Weight359.45 g/mol
Exact Mass359.12
IUPAC NameN-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide
SMILESCOCCN(Cc1ccc(C)o1)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H21NO4S/c1-15-7-9-18(24-15)14-20(11-12-23-2)25(21,22)19-10-8-16-5-3-4-6-17(16)13-19/h3-10,13H,11-12,14H2,1-2H3
InChIKeyPBOBQHVGDKLWSC-UHFFFAOYSA-N
XLogP3.58
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.45
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]benzenesulfonamide
CID 3552331
2-[benzenesulfonyl(2-methoxyethyl)amino]-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)acetamide
CID 4030296
N-(2,3-dimethylphenyl)-2-[2-methoxyethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 24678241
N-[2-(dimethylamino)ethyl]-3-methyl-N-[(5-methylfuran-2-yl)methyl]-4-propan-2-yloxybenzenesulfonamide
CID 60529997
N-ethyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]naphthalene-2-sulfonamide
CID 35527308
N-ethyl-N-(3-hydroxypropyl)naphthalene-2-sulfonamide
CID 115755343
1-(7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl)-N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]methanesulfonamide
CID 4010573
4-methoxy-N-(2-methoxyethyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 4903579
N-[2-(3-chlorophenoxy)ethyl]-N-(furan-2-ylmethyl)-4-methoxybenzenesulfonamide
CID 18285388
N-(2-methoxyethyl)-N-[(1-prop-2-ynylpiperidin-3-yl)methyl]naphthalene-2-sulfonamide
CID 134133379
1-(2-methoxyethyl)-3,3-dimethyl-1-[(5-methylfuran-2-yl)methyl]urea
CID 4238686
3-amino-4-bromo-N,N-bis(2-methoxyethyl)benzenesulfonamide
CID 115328826

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide?
The IUPAC name of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide (CID 42773342) is N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide is COCCN(Cc1ccc(C)o1)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide?
The InChIKey is PBOBQHVGDKLWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO4S/c1-15-7-9-18(24-15)14-20(11-12-23-2)25(21,22)19-10-8-16-5-3-4-6-17(16)13-19/h3-10,13H,11-12,14H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide?
N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide has a molecular weight of 359.45 g/mol, XLogP of 3.58, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 42773342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).