1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide

C19H19N5O2S — CID 22206862

IUPAC1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)Nc2ccn(Cc3cccc4ccccc34)n2)cn1
InChIInChI=1S/C19H19N5O2S/c1-2-23-14-17(12-20-23)27(25,26)22-19-10-11-24(21-19)13-16-8-5-7-15-6-3-4-9-18(15)16/h3-12,14H,2,13H2,1H3,(H,21,22)
InChIKeyWGFNEMKHPJVXSV-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.10
Rot. Bonds6

About 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide

1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide (PubChem CID 22206862) has the molecular formula C19H19N5O2S and a molecular weight of 381.46 g/mol. Its IUPAC name is 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide
PubChem CID22206862
Molecular FormulaC19H19N5O2S
Molecular Weight381.46 g/mol
Exact Mass381.13
IUPAC Name1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)Nc2ccn(Cc3cccc4ccccc34)n2)cn1
InChIInChI=1S/C19H19N5O2S/c1-2-23-14-17(12-20-23)27(25,26)22-19-10-11-24(21-19)13-16-8-5-7-15-6-3-4-9-18(15)16/h3-12,14H,2,13H2,1H3,(H,21,22)
InChIKeyWGFNEMKHPJVXSV-UHFFFAOYSA-N
XLogP3.10
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]benzenesulfonamide
CID 22206833
4-methoxy-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]benzenesulfonamide
CID 17022744
3,4-difluoro-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]benzenesulfonamide
CID 22206847
N-[1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-1-ethylpyrazole-4-sulfonamide
CID 22206959
N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-2,1,3-benzothiadiazole-4-sulfonamide
CID 22206859
N-(1-ethylpyrazol-3-yl)-1-pyridin-2-ylpyrazole-4-sulfonamide
CID 71688053
N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]acetamide
CID 19398605
4-methyl-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]benzenesulfonamide
CID 19578079
4-ethoxy-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]benzenesulfonamide
CID 22204570
N-[1-[(2-chlorophenyl)methyl]pyrazol-3-yl]benzenesulfonamide
CID 22203582
N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]-2-phenylacetamide
CID 19394819
N-[2,6-di(propan-2-yl)phenyl]-1-ethylpyrazole-4-sulfonamide
CID 19684001

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide?
The IUPAC name of 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide (CID 22206862) is 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide.
What is the SMILES notation for 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide?
The canonical SMILES for 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide is CCn1cc(S(=O)(=O)Nc2ccn(Cc3cccc4ccccc34)n2)cn1.
What is the InChIKey of 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide?
The InChIKey is WGFNEMKHPJVXSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2S/c1-2-23-14-17(12-20-23)27(25,26)22-19-10-11-24(21-19)13-16-8-5-7-15-6-3-4-9-18(15)16/h3-12,14H,2,13H2,1H3,(H,21,22).
What are the key properties of 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide?
1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide has a molecular weight of 381.46 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-3-yl]pyrazole-4-sulfonamide is sourced from PubChem (CID 22206862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).