7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C21H31N5O — CID 131673277

IUPAC7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(C)CNC(=O)c1cnn2c(C3CCCN(C4CCCC4)C3)ccnc12
InChIInChI=1S/C21H31N5O/c1-15(2)12-23-21(27)18-13-24-26-19(9-10-22-20(18)26)16-6-5-11-25(14-16)17-7-3-4-8-17/h9-10,13,15-17H,3-8,11-12,14H2,1-2H3,(H,23,27)
InChIKeyJWNUWSPDBARFHC-UHFFFAOYSA-N
MW369.51 g/mol
LogP3.24
Rot. Bonds5

About 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 131673277) has the molecular formula C21H31N5O and a molecular weight of 369.51 g/mol. Its IUPAC name is 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID131673277
Molecular FormulaC21H31N5O
Molecular Weight369.51 g/mol
Exact Mass369.25
IUPAC Name7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC(C)CNC(=O)c1cnn2c(C3CCCN(C4CCCC4)C3)ccnc12
InChIInChI=1S/C21H31N5O/c1-15(2)12-23-21(27)18-13-24-26-19(9-10-22-20(18)26)16-6-5-11-25(14-16)17-7-3-4-8-17/h9-10,13,15-17H,3-8,11-12,14H2,1-2H3,(H,23,27)
InChIKeyJWNUWSPDBARFHC-UHFFFAOYSA-N
XLogP3.24
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.51
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-[(3R)-1-cyclopentylpiperidin-3-yl]-N,N-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 125020255
7-[(3S)-1-cyclopentylpyrrolidin-3-yl]-N,N-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 125000527
7-(1-acetylpiperidin-3-yl)-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 110101018
N-methyl-7-[(3R)-1-propanoylpiperidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124974777
N-methyl-7-[(3S)-1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124985983
N-methyl-7-[(3S)-1-(1,3-thiazol-5-ylmethyl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124987425
N-methyl-7-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124952194
7-[(3S)-1-[2-(4-fluorophenyl)acetyl]piperidin-3-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124942504
N,N-dimethyl-7-[(3S)-1-propan-2-ylpyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124992229
7-[(3S)-1-benzylpiperidin-3-yl]-N,N-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124975578
7-[(3R)-1-(2-methoxyacetyl)piperidin-3-yl]-N,N-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124959760
N-methyl-7-[(3R)-1-(6-methylpyridine-3-carbonyl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124964829

Frequently Asked Questions

What is the IUPAC name of 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 131673277) is 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CC(C)CNC(=O)c1cnn2c(C3CCCN(C4CCCC4)C3)ccnc12.
What is the InChIKey of 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is JWNUWSPDBARFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N5O/c1-15(2)12-23-21(27)18-13-24-26-19(9-10-22-20(18)26)16-6-5-11-25(14-16)17-7-3-4-8-17/h9-10,13,15-17H,3-8,11-12,14H2,1-2H3,(H,23,27).
What are the key properties of 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 369.51 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-cyclopentylpiperidin-3-yl)-N-(2-methylpropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 131673277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).