N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide

C17H24N4O2S — CID 95744323

IUPACN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
SMILESCN(C)CCn1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)cn1
InChIInChI=1S/C17H24N4O2S/c1-20(2)9-10-21-13-16(12-18-21)19-24(22,23)17-8-7-14-5-3-4-6-15(14)11-17/h7-8,11-13,19H,3-6,9-10H2,1-2H3
InChIKeyOJZWLXNRFXEDCC-UHFFFAOYSA-N
MW348.47 g/mol
LogP2.12
Rot. Bonds6

About N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide

N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide (PubChem CID 95744323) has the molecular formula C17H24N4O2S and a molecular weight of 348.47 g/mol. Its IUPAC name is N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
PubChem CID95744323
Molecular FormulaC17H24N4O2S
Molecular Weight348.47 g/mol
Exact Mass348.16
IUPAC NameN-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
SMILESCN(C)CCn1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)cn1
InChIInChI=1S/C17H24N4O2S/c1-20(2)9-10-21-13-16(12-18-21)19-24(22,23)17-8-7-14-5-3-4-6-15(14)11-17/h7-8,11-13,19H,3-6,9-10H2,1-2H3
InChIKeyOJZWLXNRFXEDCC-UHFFFAOYSA-N
XLogP2.12
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.47
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-aminoethyl)-N-(2,3-dihydro-1H-inden-5-yl)pyrazole-4-sulfonamide
CID 106059548
N-pyrimidin-5-yl-2,3-dihydro-1H-indene-5-sulfonamide
CID 167882461
N-(1-ethylpyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide
CID 31913122
4-(2,3-dihydro-1H-inden-5-ylsulfonylamino)-N,N-dimethylbenzamide
CID 24580864
N,N-diethyl-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzamide
CID 7938792
N-(2-methylimidazo[1,2-a]pyridin-6-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 110734864
N-[1-(cyclopropylmethyl)pyrazol-4-yl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide
CID 126778091
N-(1-methylbenzimidazol-5-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 110728587
N-(2-methyl-1,2,4-triazol-3-yl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 71917726
N-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 7517975
3-bromo-N-(1-ethylpyrazol-4-yl)-4-fluorobenzenesulfonamide
CID 71991658
N-[1-(2-methoxyethyl)indazol-6-yl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 71884839

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide?
The IUPAC name of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide (CID 95744323) is N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide.
What is the SMILES notation for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide?
The canonical SMILES for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide is CN(C)CCn1cc(NS(=O)(=O)c2ccc3c(c2)CCCC3)cn1.
What is the InChIKey of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide?
The InChIKey is OJZWLXNRFXEDCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2S/c1-20(2)9-10-21-13-16(12-18-21)19-24(22,23)17-8-7-14-5-3-4-6-15(14)11-17/h7-8,11-13,19H,3-6,9-10H2,1-2H3.
What are the key properties of N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide?
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide has a molecular weight of 348.47 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide is sourced from PubChem (CID 95744323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).