N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

C25H27N7O2 — CID 166165038

IUPACN-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc2nc(-n3ccc(-c4ccccc4)n3)cc(N3CCOCC3)n2n1
InChIInChI=1S/C25H27N7O2/c33-25(26-19-8-4-5-9-19)21-16-23-27-22(17-24(32(23)29-21)30-12-14-34-15-13-30)31-11-10-20(28-31)18-6-2-1-3-7-18/h1-3,6-7,10-11,16-17,19H,4-5,8-9,12-15H2,(H,26,33)
InChIKeyGXWMLFJPODSCDD-UHFFFAOYSA-N
MW457.54 g/mol
LogP3.09
Rot. Bonds5

About N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 166165038) has the molecular formula C25H27N7O2 and a molecular weight of 457.54 g/mol. Its IUPAC name is N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID166165038
Molecular FormulaC25H27N7O2
Molecular Weight457.54 g/mol
Exact Mass457.22
IUPAC NameN-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESO=C(NC1CCCC1)c1cc2nc(-n3ccc(-c4ccccc4)n3)cc(N3CCOCC3)n2n1
InChIInChI=1S/C25H27N7O2/c33-25(26-19-8-4-5-9-19)21-16-23-27-22(17-24(32(23)29-21)30-12-14-34-15-13-30)31-11-10-20(28-31)18-6-2-1-3-7-18/h1-3,6-7,10-11,16-17,19H,4-5,8-9,12-15H2,(H,26,33)
InChIKeyGXWMLFJPODSCDD-UHFFFAOYSA-N
XLogP3.09
TPSA89.58 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.54
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

5-[3-(3-methylphenyl)pyrazol-1-yl]-7-morpholin-4-yl-N-propan-2-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 166165027
N-cyclopentyl-N-methyl-5-[3-(3-methylphenyl)pyrazol-1-yl]-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 166165077
N,N-dimethyl-5-[3-(3-methylphenyl)pyrazol-1-yl]-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 166165086
N-(1-methylpyrrolidin-3-yl)-5-phenyl-7-piperidin-1-ylpyrazolo[1,5-a]pyrimidine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 175922920
4-[2-(2,5-dimethylpyrazol-3-yl)-5-[3-(3-methylphenyl)pyrazol-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]morpholine
CID 166064352
ethyl 5-morpholin-4-yl-7-(3-phenylpyrazol-1-yl)imidazo[1,2-a]pyrimidine-2-carboxylate
CID 166155984
N-cyclopropyl-7-methyl-4-morpholin-4-yl-2-(3-phenylpyrazol-1-yl)furo[3,2-d]pyrimidine-6-carboxamide
CID 166738321
4-[5-[3-(3-methylphenyl)pyrazol-1-yl]-2-(1-oxidopyridin-1-ium-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine
CID 163266571
2-(1,2-dimethyl-3H-pyrazol-3-yl)-5-(3-phenylpyrazol-1-yl)-7-piperidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 167214470
N-cycloheptyl-1-(5-methyl-2-phenylpyrazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxamide
CID 46378584
4-[5-(4-phenylpyrazol-1-yl)-2-pyridin-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]morpholine
CID 166064373
7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)furo[3,2-b]pyridine-2-carboxylic acid
CID 166156177

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 166165038) is N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is O=C(NC1CCCC1)c1cc2nc(-n3ccc(-c4ccccc4)n3)cc(N3CCOCC3)n2n1.
What is the InChIKey of N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is GXWMLFJPODSCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N7O2/c33-25(26-19-8-4-5-9-19)21-16-23-27-22(17-24(32(23)29-21)30-12-14-34-15-13-30)31-11-10-20(28-31)18-6-2-1-3-7-18/h1-3,6-7,10-11,16-17,19H,4-5,8-9,12-15H2,(H,26,33).
What are the key properties of N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 457.54 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-7-morpholin-4-yl-5-(3-phenylpyrazol-1-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 166165038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).