7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine

C17H18N4O — CID 95861445

IUPAC7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine
SMILESCO[C@@H]1CCN(c2cc(-c3ccccc3)nc3ccnn23)C1
InChIInChI=1S/C17H18N4O/c1-22-14-8-10-20(12-14)17-11-15(13-5-3-2-4-6-13)19-16-7-9-18-21(16)17/h2-7,9,11,14H,8,10,12H2,1H3/t14-/m1/s1
InChIKeyJOMDJDRQWZTWPS-CQSZACIVSA-N
MW294.36 g/mol
LogP2.62
Rot. Bonds3

About 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine

7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine (PubChem CID 95861445) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine
PubChem CID95861445
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC Name7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine
SMILESCO[C@@H]1CCN(c2cc(-c3ccccc3)nc3ccnn23)C1
InChIInChI=1S/C17H18N4O/c1-22-14-8-10-20(12-14)17-11-15(13-5-3-2-4-6-13)19-16-7-9-18-21(16)17/h2-7,9,11,14H,8,10,12H2,1H3/t14-/m1/s1
InChIKeyJOMDJDRQWZTWPS-CQSZACIVSA-N
XLogP2.62
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine (CID 95861445) is 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine is CO[C@@H]1CCN(c2cc(-c3ccccc3)nc3ccnn23)C1.
What is the InChIKey of 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine?
The InChIKey is JOMDJDRQWZTWPS-CQSZACIVSA-N. The full InChI is InChI=1S/C17H18N4O/c1-22-14-8-10-20(12-14)17-11-15(13-5-3-2-4-6-13)19-16-7-9-18-21(16)17/h2-7,9,11,14H,8,10,12H2,1H3/t14-/m1/s1.
What are the key properties of 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine?
7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine has a molecular weight of 294.36 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3R)-3-methoxypyrrolidin-1-yl]-5-phenylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 95861445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).