3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide

C11H20N4O2S — CID 60808791

IUPAC3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)N(C)C2CCCC2)c(N)n1
InChIInChI=1S/C11H20N4O2S/c1-3-15-8-10(11(12)13-15)18(16,17)14(2)9-6-4-5-7-9/h8-9H,3-7H2,1-2H3,(H2,12,13)
InChIKeyYNPRCCSCHIYNFE-UHFFFAOYSA-N
MW272.37 g/mol
LogP1.05
Rot. Bonds4

About 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide

3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide (PubChem CID 60808791) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide
PubChem CID60808791
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC Name3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)N(C)C2CCCC2)c(N)n1
InChIInChI=1S/C11H20N4O2S/c1-3-15-8-10(11(12)13-15)18(16,17)14(2)9-6-4-5-7-9/h8-9H,3-7H2,1-2H3,(H2,12,13)
InChIKeyYNPRCCSCHIYNFE-UHFFFAOYSA-N
XLogP1.05
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-cyclopentyl-N,1-diethylpyrazole-4-sulfonamide
CID 54922474
3-amino-N-methyl-N-(1-methylpiperidin-4-yl)-1-propylpyrazole-4-sulfonamide
CID 60814704
3-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]-1-ethylpyrazole-4-sulfonamide
CID 63315016
3-amino-N,1-diethyl-N-methylpyrazole-4-sulfonamide
CID 60807966
3-amino-N-cyclooctyl-1-ethylpyrazole-4-sulfonamide
CID 60808927
1-ethyl-4-(2-methylpiperidin-1-yl)sulfonylpyrazol-3-amine
CID 60814183
3-amino-1-ethyl-N-methyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 60892701
4-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylsulfonyl)-1-ethylpyrazol-3-amine
CID 65318955
4-[3-(diethylamino)pyrrolidin-1-yl]sulfonyl-1-ethylpyrazol-3-amine
CID 63168177
3-amino-N-cyclopropyl-1-ethyl-N-(thiophen-2-ylmethyl)pyrazole-4-sulfonamide
CID 61111603
3-amino-N,1-dimethyl-N-(4-methylcyclohexyl)pyrazole-4-sulfonamide
CID 61106043
3-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-4-sulfonamide
CID 62087291

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide?
The IUPAC name of 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide (CID 60808791) is 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide.
What is the SMILES notation for 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide?
The canonical SMILES for 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide is CCn1cc(S(=O)(=O)N(C)C2CCCC2)c(N)n1.
What is the InChIKey of 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide?
The InChIKey is YNPRCCSCHIYNFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-3-15-8-10(11(12)13-15)18(16,17)14(2)9-6-4-5-7-9/h8-9H,3-7H2,1-2H3,(H2,12,13).
What are the key properties of 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide?
3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopentyl-1-ethyl-N-methylpyrazole-4-sulfonamide is sourced from PubChem (CID 60808791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).