N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C21H23N5O2 — CID 167907652

IUPACN-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1CCOC2(CCCC2)C1)c1cnn2c(-c3cccnc3)ccnc12
InChIInChI=1S/C21H23N5O2/c27-20(25-16-6-11-28-21(12-16)7-1-2-8-21)17-14-24-26-18(5-10-23-19(17)26)15-4-3-9-22-13-15/h3-5,9-10,13-14,16H,1-2,6-8,11-12H2,(H,25,27)
InChIKeyGHAXKLODTAJUTM-UHFFFAOYSA-N
MW377.45 g/mol
LogP3.01
Rot. Bonds3

About N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 167907652) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID167907652
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC NameN-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1CCOC2(CCCC2)C1)c1cnn2c(-c3cccnc3)ccnc12
InChIInChI=1S/C21H23N5O2/c27-20(25-16-6-11-28-21(12-16)7-1-2-8-21)17-14-24-26-18(5-10-23-19(17)26)15-4-3-9-22-13-15/h3-5,9-10,13-14,16H,1-2,6-8,11-12H2,(H,25,27)
InChIKeyGHAXKLODTAJUTM-UHFFFAOYSA-N
XLogP3.01
TPSA81.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

N-(4-hydroxycyclohexyl)-7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 110895303
N-cyclohexyl-7-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 46050171
N-(2-cyclopropyl-2-hydroxypropyl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 126830270
N-cyclopentyl-7-(3,4-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 53109662
7-(1,3-benzodioxol-5-yl)-N-cyclopropylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42855325
N,N-diethyl-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166249777
N-cyclohexyl-7-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42855267
2-methyl-N-(5-oxaspiro[3.5]nonan-8-yl)pyridine-4-carboxamide
CID 166234579
N-(1,9-dioxaspiro[5.5]undecan-4-yl)-2-pyridin-3-ylacetamide
CID 77087174
N-(6-oxaspiro[4.5]decan-9-yl)-6-phenoxypyridine-3-carboxamide
CID 127600072
N-(3-cyclopentylpropyl)-7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55828845
N-[(4R)-1-oxaspiro[5.5]undecan-4-yl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 99714773

Frequently Asked Questions

What is the IUPAC name of N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 167907652) is N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(NC1CCOC2(CCCC2)C1)c1cnn2c(-c3cccnc3)ccnc12.
What is the InChIKey of N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is GHAXKLODTAJUTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c27-20(25-16-6-11-28-21(12-16)7-1-2-8-21)17-14-24-26-18(5-10-23-19(17)26)15-4-3-9-22-13-15/h3-5,9-10,13-14,16H,1-2,6-8,11-12H2,(H,25,27).
What are the key properties of N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 377.45 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxaspiro[4.5]decan-9-yl)-7-pyridin-3-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 167907652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).