N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide

C10H18N4O2S — CID 114146761

IUPACN-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide
SMILESCn1nccc1S(=O)(=O)NCC1CCC(N)C1
InChIInChI=1S/C10H18N4O2S/c1-14-10(4-5-12-14)17(15,16)13-7-8-2-3-9(11)6-8/h4-5,8-9,13H,2-3,6-7,11H2,1H3
InChIKeyPRKFTGITTXNPLI-UHFFFAOYSA-N
MW258.35 g/mol
LogP-0.17
Rot. Bonds4

About N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide

N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide (PubChem CID 114146761) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide.

Molecular Properties

Compound NameN-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide
PubChem CID114146761
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC NameN-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide
SMILESCn1nccc1S(=O)(=O)NCC1CCC(N)C1
InChIInChI=1S/C10H18N4O2S/c1-14-10(4-5-12-14)17(15,16)13-7-8-2-3-9(11)6-8/h4-5,8-9,13H,2-3,6-7,11H2,1H3
InChIKeyPRKFTGITTXNPLI-UHFFFAOYSA-N
XLogP-0.17
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide;hydrochloride
CID 120708226
2-methyl-N-(pyrrolidin-2-ylmethyl)pyrazole-3-sulfonamide
CID 104710228
N-[[(1R,2S)-2-cyclohexylcyclopropyl]methyl]-2-methylpyrazole-3-sulfonamide
CID 128511768
2-methyl-N-[[(2R,3S)-1-methyl-2-(2-methylpyrazol-3-yl)piperidin-3-yl]methyl]pyrazole-3-sulfonamide
CID 128977860
N-[4-(bromomethyl)cyclohexyl]-2-methylpyrazole-3-sulfonamide
CID 112753047
2-[(2-methylpyrazol-3-yl)sulfonylamino]acetamide
CID 104709783
N-[2-(cycloheptylamino)ethyl]-2-methylpyrazole-3-sulfonamide
CID 104710326
N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide
CID 113443991
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-methylpyrazole-3-sulfonamide
CID 104710096
N-cyclopentyl-2-methylpyrazole-3-sulfonamide
CID 104709770
N-(5-aminopentyl)-2-methylpyrazole-3-sulfonamide
CID 104709354
N-[(3-aminocyclopentyl)methyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 114146770

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide?
The IUPAC name of N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide (CID 114146761) is N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide.
What is the SMILES notation for N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide?
The canonical SMILES for N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide is Cn1nccc1S(=O)(=O)NCC1CCC(N)C1.
What is the InChIKey of N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide?
The InChIKey is PRKFTGITTXNPLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-14-10(4-5-12-14)17(15,16)13-7-8-2-3-9(11)6-8/h4-5,8-9,13H,2-3,6-7,11H2,1H3.
What are the key properties of N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide?
N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide has a molecular weight of 258.35 g/mol, XLogP of -0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclopentyl)methyl]-2-methylpyrazole-3-sulfonamide is sourced from PubChem (CID 114146761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).