6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

C20H20N6O2 — CID 164640581

IUPAC6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESO=C(N[C@@H](Cn1cccn1)c1ccccc1)c1cc2ncc(CCO)cn2n1
InChIInChI=1S/C20H20N6O2/c27-10-7-15-12-21-19-11-17(24-26(19)13-15)20(28)23-18(14-25-9-4-8-22-25)16-5-2-1-3-6-16/h1-6,8-9,11-13,18,27H,7,10,14H2,(H,23,28)/t18-/m0/s1
InChIKeyFIODPVCTOPDAII-SFHVURJKSA-N
MW376.42 g/mol
LogP1.63
Rot. Bonds7

About 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 164640581) has the molecular formula C20H20N6O2 and a molecular weight of 376.42 g/mol. Its IUPAC name is 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID164640581
Molecular FormulaC20H20N6O2
Molecular Weight376.42 g/mol
Exact Mass376.16
IUPAC Name6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESO=C(N[C@@H](Cn1cccn1)c1ccccc1)c1cc2ncc(CCO)cn2n1
InChIInChI=1S/C20H20N6O2/c27-10-7-15-12-21-19-11-17(24-26(19)13-15)20(28)23-18(14-25-9-4-8-22-25)16-5-2-1-3-6-16/h1-6,8-9,11-13,18,27H,7,10,14H2,(H,23,28)/t18-/m0/s1
InChIKeyFIODPVCTOPDAII-SFHVURJKSA-N
XLogP1.63
TPSA97.34 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 164640581) is 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is O=C(N[C@@H](Cn1cccn1)c1ccccc1)c1cc2ncc(CCO)cn2n1.
What is the InChIKey of 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is FIODPVCTOPDAII-SFHVURJKSA-N. The full InChI is InChI=1S/C20H20N6O2/c27-10-7-15-12-21-19-11-17(24-26(19)13-15)20(28)23-18(14-25-9-4-8-22-25)16-5-2-1-3-6-16/h1-6,8-9,11-13,18,27H,7,10,14H2,(H,23,28)/t18-/m0/s1.
What are the key properties of 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 376.42 g/mol, XLogP of 1.63, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyethyl)-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 164640581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).