N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide

C11H21N5O2S — CID 79524471

IUPACN-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NCc1cnn(C)c1N
InChIInChI=1S/C11H21N5O2S/c1-9-5-3-4-6-16(9)19(17,18)14-8-10-7-13-15(2)11(10)12/h7,9,14H,3-6,8,12H2,1-2H3
InChIKeyJHMACJDJAMDJEN-UHFFFAOYSA-N
MW287.39 g/mol
LogP0.21
Rot. Bonds4

About N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide

N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide (PubChem CID 79524471) has the molecular formula C11H21N5O2S and a molecular weight of 287.39 g/mol. Its IUPAC name is N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide
PubChem CID79524471
Molecular FormulaC11H21N5O2S
Molecular Weight287.39 g/mol
Exact Mass287.14
IUPAC NameN-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NCc1cnn(C)c1N
InChIInChI=1S/C11H21N5O2S/c1-9-5-3-4-6-16(9)19(17,18)14-8-10-7-13-15(2)11(10)12/h7,9,14H,3-6,8,12H2,1-2H3
InChIKeyJHMACJDJAMDJEN-UHFFFAOYSA-N
XLogP0.21
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(5-amino-1-methylpyrazol-4-yl)methyl]cyclohexanesulfonamide
CID 79523429
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-3,5-dimethylpiperidine-1-sulfonamide
CID 79523252
(2S)-N-[(2-chlorophenyl)methyl]-2-methylpiperidine-1-sulfonamide
CID 35293436
N-[(5-amino-1-methylpyrazol-4-yl)methyl]methanesulfonamide
CID 79523433
2-methyl-N-(1H-pyrrol-3-ylmethyl)piperidine-1-sulfonamide
CID 106386243
(2R)-N-[(4-chlorophenyl)methyl]-2-methylpiperidine-1-sulfonamide
CID 35288491
N-[(5-amino-1-methylpyrazol-4-yl)methyl]propane-2-sulfonamide
CID 79524212
1-(5-bromo-1-methylpyrazol-4-yl)sulfonyl-2-methylpiperidine
CID 126823017
(2R)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-methylpiperidine-1-sulfonamide
CID 94381377
5-amino-4-[(dipropylsulfamoylamino)methyl]-1-methylpyrazole
CID 79523701
N-(3-amino-4-pyridinyl)-2-methylpiperidine-1-sulfonamide
CID 63063634
2-(aminomethyl)-N-[(4-methyl-3-pyridinyl)methyl]piperidine-1-sulfonamide
CID 106085863

Frequently Asked Questions

What is the IUPAC name of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide?
The IUPAC name of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide (CID 79524471) is N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide is CC1CCCCN1S(=O)(=O)NCc1cnn(C)c1N.
What is the InChIKey of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide?
The InChIKey is JHMACJDJAMDJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O2S/c1-9-5-3-4-6-16(9)19(17,18)14-8-10-7-13-15(2)11(10)12/h7,9,14H,3-6,8,12H2,1-2H3.
What are the key properties of N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide?
N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide has a molecular weight of 287.39 g/mol, XLogP of 0.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-amino-1-methylpyrazol-4-yl)methyl]-2-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 79524471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).