N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide

C16H23N5O — CID 134798422

IUPACN-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide
SMILESCC(C)CNC(=O)C1CCN(c2ccnc3ccnn23)CC1
InChIInChI=1S/C16H23N5O/c1-12(2)11-18-16(22)13-5-9-20(10-6-13)15-4-7-17-14-3-8-19-21(14)15/h3-4,7-8,12-13H,5-6,9-11H2,1-2H3,(H,18,22)
InChIKeyJFPLDQOMFMJDMI-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.72
Rot. Bonds4

About N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide

N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide (PubChem CID 134798422) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide
PubChem CID134798422
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC NameN-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide
SMILESCC(C)CNC(=O)C1CCN(c2ccnc3ccnn23)CC1
InChIInChI=1S/C16H23N5O/c1-12(2)11-18-16(22)13-5-9-20(10-6-13)15-4-7-17-14-3-8-19-21(14)15/h3-4,7-8,12-13H,5-6,9-11H2,1-2H3,(H,18,22)
InChIKeyJFPLDQOMFMJDMI-UHFFFAOYSA-N
XLogP1.72
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide?
The IUPAC name of N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide (CID 134798422) is N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide is CC(C)CNC(=O)C1CCN(c2ccnc3ccnn23)CC1.
What is the InChIKey of N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide?
The InChIKey is JFPLDQOMFMJDMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-12(2)11-18-16(22)13-5-9-20(10-6-13)15-4-7-17-14-3-8-19-21(14)15/h3-4,7-8,12-13H,5-6,9-11H2,1-2H3,(H,18,22).
What are the key properties of N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide?
N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-4-carboxamide is sourced from PubChem (CID 134798422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).