N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C17H23N5O — CID 53171797

IUPACN-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(N2CCCC2)n2nccc2n1
InChIInChI=1S/C17H23N5O/c23-17(19-13-6-2-1-3-7-13)14-12-16(21-10-4-5-11-21)22-15(20-14)8-9-18-22/h8-9,12-13H,1-7,10-11H2,(H,19,23)
InChIKeyAOSQJLRUNVAZGN-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.39
Rot. Bonds3

About N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide

N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 53171797) has the molecular formula C17H23N5O and a molecular weight of 313.40 g/mol. Its IUPAC name is N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID53171797
Molecular FormulaC17H23N5O
Molecular Weight313.40 g/mol
Exact Mass313.19
IUPAC NameN-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESO=C(NC1CCCCC1)c1cc(N2CCCC2)n2nccc2n1
InChIInChI=1S/C17H23N5O/c23-17(19-13-6-2-1-3-7-13)14-12-16(21-10-4-5-11-21)22-15(20-14)8-9-18-22/h8-9,12-13H,1-7,10-11H2,(H,19,23)
InChIKeyAOSQJLRUNVAZGN-UHFFFAOYSA-N
XLogP2.39
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cycloheptyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110855510
2-methyl-N-[1-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]pyrazole-3-carboxamide
CID 172892022
N-cyclohexyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112450
N-cycloheptyl-1-pyrazolo[1,5-a]pyrimidin-7-ylazetidine-3-carboxamide
CID 134795993
6-(azepan-1-yl)-N-cyclohexylpyridine-2-carboxamide
CID 84573746
6-(azepan-1-yl)-N-cycloheptylpyridine-2-carboxamide
CID 84573847
1-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)-N-(oxan-4-yl)piperidine-4-carboxamide
CID 171993207
5-(azepan-1-yl)-N-cyclohexylpyridine-2-carboxamide
CID 109182978
4-(2-hydroxypropan-2-yl)-N-(7-piperidin-1-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
CID 143873056
5-phenyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 154842512
N-cyclohexyl-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080315
N-cyclopropylpyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 110848067

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 53171797) is N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide is O=C(NC1CCCCC1)c1cc(N2CCCC2)n2nccc2n1.
What is the InChIKey of N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is AOSQJLRUNVAZGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O/c23-17(19-13-6-2-1-3-7-13)14-12-16(21-10-4-5-11-21)22-15(20-14)8-9-18-22/h8-9,12-13H,1-7,10-11H2,(H,19,23).
What are the key properties of N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-7-pyrrolidin-1-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 53171797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).