N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide

C21H24N6O — CID 71160808

IUPACN-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide
SMILESCN1CCCC(c2cc(NC(=O)c3cccnc3)n3ncc(C4CC4)c3n2)C1
InChIInChI=1S/C21H24N6O/c1-26-9-3-5-16(13-26)18-10-19(25-21(28)15-4-2-8-22-11-15)27-20(24-18)17(12-23-27)14-6-7-14/h2,4,8,10-12,14,16H,3,5-7,9,13H2,1H3,(H,25,28)
InChIKeyIJOIMIAEYCECBZ-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.06
Rot. Bonds4

About N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide

N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide (PubChem CID 71160808) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide
PubChem CID71160808
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC NameN-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide
SMILESCN1CCCC(c2cc(NC(=O)c3cccnc3)n3ncc(C4CC4)c3n2)C1
InChIInChI=1S/C21H24N6O/c1-26-9-3-5-16(13-26)18-10-19(25-21(28)15-4-2-8-22-11-15)27-20(24-18)17(12-23-27)14-6-7-14/h2,4,8,10-12,14,16H,3,5-7,9,13H2,1H3,(H,25,28)
InChIKeyIJOIMIAEYCECBZ-UHFFFAOYSA-N
XLogP3.06
TPSA75.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide?
The IUPAC name of N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide (CID 71160808) is N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide is CN1CCCC(c2cc(NC(=O)c3cccnc3)n3ncc(C4CC4)c3n2)C1.
What is the InChIKey of N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide?
The InChIKey is IJOIMIAEYCECBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c1-26-9-3-5-16(13-26)18-10-19(25-21(28)15-4-2-8-22-11-15)27-20(24-18)17(12-23-27)14-6-7-14/h2,4,8,10-12,14,16H,3,5-7,9,13H2,1H3,(H,25,28).
What are the key properties of N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide?
N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-cyclopropyl-5-(1-methylpiperidin-3-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyridine-3-carboxamide is sourced from PubChem (CID 71160808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).