7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C25H24FN5O2 — CID 42877286

IUPAC7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc(-c2ccccc2F)n2nc(-c3ccccc3)cc2n1
InChIInChI=1S/C25H24FN5O2/c26-20-9-5-4-8-19(20)23-16-22(25(32)27-10-11-30-12-14-33-15-13-30)28-24-17-21(29-31(23)24)18-6-2-1-3-7-18/h1-9,16-17H,10-15H2,(H,27,32)
InChIKeyFCBQPRMNPSCKRS-UHFFFAOYSA-N
MW445.50 g/mol
LogP3.26
Rot. Bonds6

About 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide

7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 42877286) has the molecular formula C25H24FN5O2 and a molecular weight of 445.50 g/mol. Its IUPAC name is 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound Name7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID42877286
Molecular FormulaC25H24FN5O2
Molecular Weight445.50 g/mol
Exact Mass445.19
IUPAC Name7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc(-c2ccccc2F)n2nc(-c3ccccc3)cc2n1
InChIInChI=1S/C25H24FN5O2/c26-20-9-5-4-8-19(20)23-16-22(25(32)27-10-11-30-12-14-33-15-13-30)28-24-17-21(29-31(23)24)18-6-2-1-3-7-18/h1-9,16-17H,10-15H2,(H,27,32)
InChIKeyFCBQPRMNPSCKRS-UHFFFAOYSA-N
XLogP3.26
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.50
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-(2-fluorophenyl)-2-phenyl-N-(2-pyrrolidin-1-ylethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 42877285
7-(2-fluorophenyl)-2-phenyl-N-propylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 46079633
6-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42876582
2-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)-N-(2-morpholin-4-ylethyl)acetamide
CID 23604016
2-(4-chlorophenyl)-5-(4-fluorophenyl)-N-(2-morpholin-4-ylethyl)pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 42877602
N-(2-morpholin-4-ylethyl)-2-oxo-4-phenyl-1H-pyrimidine-6-carboxamide
CID 110332072
N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 4080489
N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide
CID 51253349
6-(cyclopropylamino)-N-(2-morpholin-4-ylethyl)-2-phenylpyrimidine-4-carboxamide
CID 112851709
7-(2-methoxyphenyl)-2-methyl-N-(3-morpholin-4-ylpropyl)-3-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 46079765
5-(7-fluoroimidazo[1,2-a]pyridin-2-yl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 46208539
N-(2-morpholin-4-ylethyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 5053341

Frequently Asked Questions

What is the IUPAC name of 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 42877286) is 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide is O=C(NCCN1CCOCC1)c1cc(-c2ccccc2F)n2nc(-c3ccccc3)cc2n1.
What is the InChIKey of 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is FCBQPRMNPSCKRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24FN5O2/c26-20-9-5-4-8-19(20)23-16-22(25(32)27-10-11-30-12-14-33-15-13-30)28-24-17-21(29-31(23)24)18-6-2-1-3-7-18/h1-9,16-17H,10-15H2,(H,27,32).
What are the key properties of 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 445.50 g/mol, XLogP of 3.26, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-fluorophenyl)-N-(2-morpholin-4-ylethyl)-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 42877286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).