N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide

C15H21N5O — CID 134797512

IUPACN-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide
SMILESCCCC(=O)NC1CCN(c2ccnc3ccnn23)CC1
InChIInChI=1S/C15H21N5O/c1-2-3-14(21)18-12-6-10-19(11-7-12)15-5-8-16-13-4-9-17-20(13)15/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,18,21)
InChIKeyDLJWVSJRKZIFJL-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.61
Rot. Bonds4

About N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide

N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide (PubChem CID 134797512) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide.

Molecular Properties

Compound NameN-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide
PubChem CID134797512
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide
SMILESCCCC(=O)NC1CCN(c2ccnc3ccnn23)CC1
InChIInChI=1S/C15H21N5O/c1-2-3-14(21)18-12-6-10-19(11-7-12)15-5-8-16-13-4-9-17-20(13)15/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,18,21)
InChIKeyDLJWVSJRKZIFJL-UHFFFAOYSA-N
XLogP1.61
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide?
The IUPAC name of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide (CID 134797512) is N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide.
What is the SMILES notation for N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide?
The canonical SMILES for N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide is CCCC(=O)NC1CCN(c2ccnc3ccnn23)CC1.
What is the InChIKey of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide?
The InChIKey is DLJWVSJRKZIFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-2-3-14(21)18-12-6-10-19(11-7-12)15-5-8-16-13-4-9-17-20(13)15/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,18,21).
What are the key properties of N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide?
N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide has a molecular weight of 287.37 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-4-yl)butanamide is sourced from PubChem (CID 134797512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).