5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide

C17H20N4O2S — CID 74226130

IUPAC5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide
SMILESCCn1nccc1NS(=O)(=O)c1cccc2c(N(C)C)cccc12
InChIInChI=1S/C17H20N4O2S/c1-4-21-17(11-12-18-21)19-24(22,23)16-10-6-7-13-14(16)8-5-9-15(13)20(2)3/h5-12,19H,4H2,1-3H3
InChIKeyFTLWAJWMZCUTJN-UHFFFAOYSA-N
MW344.44 g/mol
LogP2.92
Rot. Bonds5

About 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide

5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide (PubChem CID 74226130) has the molecular formula C17H20N4O2S and a molecular weight of 344.44 g/mol. Its IUPAC name is 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide.

Molecular Properties

Compound Name5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide
PubChem CID74226130
Molecular FormulaC17H20N4O2S
Molecular Weight344.44 g/mol
Exact Mass344.13
IUPAC Name5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide
SMILESCCn1nccc1NS(=O)(=O)c1cccc2c(N(C)C)cccc12
InChIInChI=1S/C17H20N4O2S/c1-4-21-17(11-12-18-21)19-24(22,23)16-10-6-7-13-14(16)8-5-9-15(13)20(2)3/h5-12,19H,4H2,1-3H3
InChIKeyFTLWAJWMZCUTJN-UHFFFAOYSA-N
XLogP2.92
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide?
The IUPAC name of 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide (CID 74226130) is 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide.
What is the SMILES notation for 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide?
The canonical SMILES for 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide is CCn1nccc1NS(=O)(=O)c1cccc2c(N(C)C)cccc12.
What is the InChIKey of 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide?
The InChIKey is FTLWAJWMZCUTJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2S/c1-4-21-17(11-12-18-21)19-24(22,23)16-10-6-7-13-14(16)8-5-9-15(13)20(2)3/h5-12,19H,4H2,1-3H3.
What are the key properties of 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide?
5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide has a molecular weight of 344.44 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-N-(2-ethylpyrazol-3-yl)naphthalene-1-sulfonamide is sourced from PubChem (CID 74226130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).