5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide

C14H18N2O3S — CID 12910720

IUPAC5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide
SMILESCN(C)c1cccc2c(S(=O)(=O)NCCO)cccc12
InChIInChI=1S/C14H18N2O3S/c1-16(2)13-7-3-6-12-11(13)5-4-8-14(12)20(18,19)15-9-10-17/h3-8,15,17H,9-10H2,1-2H3
InChIKeyOLNUFXNRCJFBMZ-UHFFFAOYSA-N
MW294.38 g/mol
LogP1.18
Rot. Bonds5

About 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide

5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide (PubChem CID 12910720) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide.

Molecular Properties

Compound Name5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide
PubChem CID12910720
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Name5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide
SMILESCN(C)c1cccc2c(S(=O)(=O)NCCO)cccc12
InChIInChI=1S/C14H18N2O3S/c1-16(2)13-7-3-6-12-11(13)5-4-8-14(12)20(18,19)15-9-10-17/h3-8,15,17H,9-10H2,1-2H3
InChIKeyOLNUFXNRCJFBMZ-UHFFFAOYSA-N
XLogP1.18
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(dimethylamino)-N-[2-(2-hydroxyethylamino)ethyl]naphthalene-1-sulfonamide
CID 70948428
5-[bis(trideuteriomethyl)amino]-N-(2-hydroxyethyl)naphthalene-1-sulfonamide
CID 169437063
5-(dimethylamino)-N-[6-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]hexyl]naphthalene-1-sulfonamide
CID 14008934
N-(4-aminobutyl)-5-(dimethylamino)naphthalene-1-sulfonamide
CID 14656966
[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]methylphosphonic acid
CID 10641161
5-(dimethylamino)-N-(2-oxoethyl)naphthalene-1-sulfonamide
CID 18702175
N-[2-(4-aminophenyl)ethyl]-5-(dimethylamino)naphthalene-1-sulfonamide
CID 54343752
N-[2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]ethyl]-2-methoxyacetamide
CID 23378485
5-(dimethylamino)-N-(3-iodoprop-2-ynyl)naphthalene-1-sulfonamide
CID 170856983
5-(dimethylamino)-N-(3-propoxypropyl)naphthalene-1-sulfonamide
CID 3456348
N-[3-(8-aminooctylamino)propyl]-5-(dimethylamino)naphthalene-1-sulfonamide
CID 58260368
propan-2-yl 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]acetate
CID 3852604

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide?
The IUPAC name of 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide (CID 12910720) is 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide.
What is the SMILES notation for 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide?
The canonical SMILES for 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide is CN(C)c1cccc2c(S(=O)(=O)NCCO)cccc12.
What is the InChIKey of 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide?
The InChIKey is OLNUFXNRCJFBMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-16(2)13-7-3-6-12-11(13)5-4-8-14(12)20(18,19)15-9-10-17/h3-8,15,17H,9-10H2,1-2H3.
What are the key properties of 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide?
5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide has a molecular weight of 294.38 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-N-(2-hydroxyethyl)naphthalene-1-sulfonamide is sourced from PubChem (CID 12910720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).