3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine

C10H18FN5O2S — CID 155400886

IUPAC3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine
SMILESCN1CCCC(N(c2cnn(C)c2F)S(N)(=O)=O)C1
InChIInChI=1S/C10H18FN5O2S/c1-14-5-3-4-8(7-14)16(19(12,17)18)9-6-13-15(2)10(9)11/h6,8H,3-5,7H2,1-2H3,(H2,12,17,18)
InChIKeyWJVAEOLEOAPVFH-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.34
Rot. Bonds3

About 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine

3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine (PubChem CID 155400886) has the molecular formula C10H18FN5O2S and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine.

Molecular Properties

Compound Name3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine
PubChem CID155400886
Molecular FormulaC10H18FN5O2S
Molecular Weight291.35 g/mol
Exact Mass291.12
IUPAC Name3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine
SMILESCN1CCCC(N(c2cnn(C)c2F)S(N)(=O)=O)C1
InChIInChI=1S/C10H18FN5O2S/c1-14-5-3-4-8(7-14)16(19(12,17)18)9-6-13-15(2)10(9)11/h6,8H,3-5,7H2,1-2H3,(H2,12,17,18)
InChIKeyWJVAEOLEOAPVFH-UHFFFAOYSA-N
XLogP-0.34
TPSA84.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine
CID 54593547
N-methyl-1-(1-methyl-1H-pyrazol-4-yl)piperidin-3-amine
CID 64270757
1-(1-methylpiperidin-4-yl)-1H-pyrazol-4-amine hydrochloride
CID 89717616
N,1-dimethyl-N-[(1-methylsulfonylpiperidin-3-yl)methyl]pyrazol-4-amine
CID 84587086
1-(2-(Piperidin-1-yl)ethyl)-1h-pyrazol-4-amine
CID 42281882
N-(1-methylpyrazol-4-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43776713
1-(1-methylpiperidin-4-yl)-1H-pyrazol-4-amine
CID 53302346
5-Chloro-1-(1-ethyl-3-fluoropiperidin-4-yl)pyrazol-4-amine
CID 67969987
1-(1-(2-flouro Ethyl) piperidin-4-yl)-1H-pyrazol-4-amine
CID 90104613
1-(3-Fluoro-1-methylpiperidin-4-yl)pyrazol-4-amine
CID 118280661
1-(1-Ethyl-3-fluoropiperidin-4-yl)pyrazol-4-amine
CID 118365615
1-[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]pyrazol-4-amine
CID 118365664

Frequently Asked Questions

What is the IUPAC name of 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine?
The IUPAC name of 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine (CID 155400886) is 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine.
What is the SMILES notation for 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine?
The canonical SMILES for 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine is CN1CCCC(N(c2cnn(C)c2F)S(N)(=O)=O)C1.
What is the InChIKey of 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine?
The InChIKey is WJVAEOLEOAPVFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN5O2S/c1-14-5-3-4-8(7-14)16(19(12,17)18)9-6-13-15(2)10(9)11/h6,8H,3-5,7H2,1-2H3,(H2,12,17,18).
What are the key properties of 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine?
3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine has a molecular weight of 291.35 g/mol, XLogP of -0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-fluoro-1-methylpyrazol-4-yl)-sulfamoylamino]-1-methylpiperidine is sourced from PubChem (CID 155400886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).