1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol

C15H16N4O — CID 56884548

IUPAC1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol
SMILESCC(O)CNc1cc(-c2ccccc2)nc2ccnn12
InChIInChI=1S/C15H16N4O/c1-11(20)10-16-15-9-13(12-5-3-2-4-6-12)18-14-7-8-17-19(14)15/h2-9,11,16,20H,10H2,1H3
InChIKeyIUEKUMHCGSGSEB-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.19
Rot. Bonds4

About 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol

1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol (PubChem CID 56884548) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol
PubChem CID56884548
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol
SMILESCC(O)CNc1cc(-c2ccccc2)nc2ccnn12
InChIInChI=1S/C15H16N4O/c1-11(20)10-16-15-9-13(12-5-3-2-4-6-12)18-14-7-8-17-19(14)15/h2-9,11,16,20H,10H2,1H3
InChIKeyIUEKUMHCGSGSEB-UHFFFAOYSA-N
XLogP2.19
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(1S,2R)-1-hydroxy-2-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propyl]phenol
CID 70722404
5-phenyl-N-[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95712908
(3S)-3-phenyl-3-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-1-ol
CID 95885389
N-[(3-amino-1H-1,2,4-triazol-5-yl)methyl]-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 70787447
5-phenyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56899654
5-[[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]methyl]-1,3-dihydrobenzimidazol-2-one
CID 70772498
N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 70734186
N-[2-(1H-imidazol-5-yl)ethyl]-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 56902858
[(3R)-1-[2-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]piperidin-3-yl]methanol
CID 95873826
5-phenyl-N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 70785677
N-[(1R)-1-(2-ethyl-1,2,4-triazol-3-yl)propyl]-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 95719174
[(1R,2R,4R,5R)-5-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]-2-bicyclo[2.2.1]heptanyl]methanol
CID 166380412

Frequently Asked Questions

What is the IUPAC name of 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol?
The IUPAC name of 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol (CID 56884548) is 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol.
What is the SMILES notation for 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol?
The canonical SMILES for 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol is CC(O)CNc1cc(-c2ccccc2)nc2ccnn12.
What is the InChIKey of 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol?
The InChIKey is IUEKUMHCGSGSEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-11(20)10-16-15-9-13(12-5-3-2-4-6-12)18-14-7-8-17-19(14)15/h2-9,11,16,20H,10H2,1H3.
What are the key properties of 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol?
1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol has a molecular weight of 268.32 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-2-ol is sourced from PubChem (CID 56884548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).