6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C20H24N6O — CID 74236670

IUPAC6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)NCC(c3cccnc3)N3CCCCC3)cnn2c1
InChIInChI=1S/C20H24N6O/c1-15-10-22-19-17(12-24-26(19)14-15)20(27)23-13-18(16-6-5-7-21-11-16)25-8-3-2-4-9-25/h5-7,10-12,14,18H,2-4,8-9,13H2,1H3,(H,23,27)
InChIKeyORGILYJGTGYHBC-UHFFFAOYSA-N
MW364.45 g/mol
LogP2.39
Rot. Bonds5

About 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 74236670) has the molecular formula C20H24N6O and a molecular weight of 364.45 g/mol. Its IUPAC name is 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID74236670
Molecular FormulaC20H24N6O
Molecular Weight364.45 g/mol
Exact Mass364.20
IUPAC Name6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cnc2c(C(=O)NCC(c3cccnc3)N3CCCCC3)cnn2c1
InChIInChI=1S/C20H24N6O/c1-15-10-22-19-17(12-24-26(19)14-15)20(27)23-13-18(16-6-5-7-21-11-16)25-8-3-2-4-9-25/h5-7,10-12,14,18H,2-4,8-9,13H2,1H3,(H,23,27)
InChIKeyORGILYJGTGYHBC-UHFFFAOYSA-N
XLogP2.39
TPSA75.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 74236670) is 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cnc2c(C(=O)NCC(c3cccnc3)N3CCCCC3)cnn2c1.
What is the InChIKey of 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is ORGILYJGTGYHBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6O/c1-15-10-22-19-17(12-24-26(19)14-15)20(27)23-13-18(16-6-5-7-21-11-16)25-8-3-2-4-9-25/h5-7,10-12,14,18H,2-4,8-9,13H2,1H3,(H,23,27).
What are the key properties of 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 74236670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).