N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide

C15H23N5O2S — CID 56911367

IUPACN-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide
SMILESCC(C)c1cc(N2CCC(NS(C)(=O)=O)CC2)n2nccc2n1
InChIInChI=1S/C15H23N5O2S/c1-11(2)13-10-15(20-14(17-13)4-7-16-20)19-8-5-12(6-9-19)18-23(3,21)22/h4,7,10-12,18H,5-6,8-9H2,1-3H3
InChIKeyPEPVYDLVKGOHET-UHFFFAOYSA-N
MW337.45 g/mol
LogP1.37
Rot. Bonds4

About N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide

N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide (PubChem CID 56911367) has the molecular formula C15H23N5O2S and a molecular weight of 337.45 g/mol. Its IUPAC name is N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide
PubChem CID56911367
Molecular FormulaC15H23N5O2S
Molecular Weight337.45 g/mol
Exact Mass337.16
IUPAC NameN-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide
SMILESCC(C)c1cc(N2CCC(NS(C)(=O)=O)CC2)n2nccc2n1
InChIInChI=1S/C15H23N5O2S/c1-11(2)13-10-15(20-14(17-13)4-7-16-20)19-8-5-12(6-9-19)18-23(3,21)22/h4,7,10-12,18H,5-6,8-9H2,1-3H3
InChIKeyPEPVYDLVKGOHET-UHFFFAOYSA-N
XLogP1.37
TPSA79.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide?
The IUPAC name of N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide (CID 56911367) is N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide.
What is the SMILES notation for N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide?
The canonical SMILES for N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide is CC(C)c1cc(N2CCC(NS(C)(=O)=O)CC2)n2nccc2n1.
What is the InChIKey of N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide?
The InChIKey is PEPVYDLVKGOHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2S/c1-11(2)13-10-15(20-14(17-13)4-7-16-20)19-8-5-12(6-9-19)18-23(3,21)22/h4,7,10-12,18H,5-6,8-9H2,1-3H3.
What are the key properties of N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide?
N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide has a molecular weight of 337.45 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]methanesulfonamide is sourced from PubChem (CID 56911367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).