3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide

C11H19N5O3S — CID 71892816

IUPAC3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)NC1CCCN(C(=O)NCc2ccn[nH]2)C1
InChIInChI=1S/C11H19N5O3S/c1-20(18,19)15-10-3-2-6-16(8-10)11(17)12-7-9-4-5-13-14-9/h4-5,10,15H,2-3,6-8H2,1H3,(H,12,17)(H,13,14)
InChIKeyOGHJXTIBFLWFIJ-UHFFFAOYSA-N
MW301.37 g/mol
LogP-0.37
Rot. Bonds4

About 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide

3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide (PubChem CID 71892816) has the molecular formula C11H19N5O3S and a molecular weight of 301.37 g/mol. Its IUPAC name is 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide
PubChem CID71892816
Molecular FormulaC11H19N5O3S
Molecular Weight301.37 g/mol
Exact Mass301.12
IUPAC Name3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide
SMILESCS(=O)(=O)NC1CCCN(C(=O)NCc2ccn[nH]2)C1
InChIInChI=1S/C11H19N5O3S/c1-20(18,19)15-10-3-2-6-16(8-10)11(17)12-7-9-4-5-13-14-9/h4-5,10,15H,2-3,6-8H2,1H3,(H,12,17)(H,13,14)
InChIKeyOGHJXTIBFLWFIJ-UHFFFAOYSA-N
XLogP-0.37
TPSA107.19 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide?
The IUPAC name of 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide (CID 71892816) is 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide?
The canonical SMILES for 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide is CS(=O)(=O)NC1CCCN(C(=O)NCc2ccn[nH]2)C1.
What is the InChIKey of 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide?
The InChIKey is OGHJXTIBFLWFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O3S/c1-20(18,19)15-10-3-2-6-16(8-10)11(17)12-7-9-4-5-13-14-9/h4-5,10,15H,2-3,6-8H2,1H3,(H,12,17)(H,13,14).
What are the key properties of 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide?
3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide has a molecular weight of 301.37 g/mol, XLogP of -0.37, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)-N-(1H-pyrazol-5-ylmethyl)piperidine-1-carboxamide is sourced from PubChem (CID 71892816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).