[(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol

C19H18N4O2 — CID 126474399

IUPAC[(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol
SMILESOC[C@@H]1CCCN1c1ccnc2c(-c3cc4ccccc4o3)cnn12
InChIInChI=1S/C19H18N4O2/c24-12-14-5-3-9-22(14)18-7-8-20-19-15(11-21-23(18)19)17-10-13-4-1-2-6-16(13)25-17/h1-2,4,6-8,10-11,14,24H,3,5,9,12H2/t14-/m0/s1
InChIKeyJDAQAZXWXPVOGK-AWEZNQCLSA-N
MW334.38 g/mol
LogP3.10
Rot. Bonds3

About [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol

[(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol (PubChem CID 126474399) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol
PubChem CID126474399
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name[(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol
SMILESOC[C@@H]1CCCN1c1ccnc2c(-c3cc4ccccc4o3)cnn12
InChIInChI=1S/C19H18N4O2/c24-12-14-5-3-9-22(14)18-7-8-20-19-15(11-21-23(18)19)17-10-13-4-1-2-6-16(13)25-17/h1-2,4,6-8,10-11,14,24H,3,5,9,12H2/t14-/m0/s1
InChIKeyJDAQAZXWXPVOGK-AWEZNQCLSA-N
XLogP3.10
TPSA66.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol with MolForge

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

Launch Full Analysis

Related Compounds

[(2S)-1-[3-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol
CID 126469583
4-[7-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]benzonitrile
CID 126475579
[(2S)-1-[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol
CID 126473236
3-[7-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]benzoic acid
CID 126474263
[1-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-2-yl]methanol
CID 66995898
[1-(1,3-benzoxazol-2-yl)pyrrolidin-2-yl]methanol
CID 22220871
[1-(2-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 62770947
N-[1-(1-benzofuran-2-yl)ethyl]-2-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 111427777
[1-[3-(aminomethyl)quinolin-2-yl]pyrrolidin-2-yl]methanol
CID 61410857
[(2S)-1-[[3-(1-benzofuran-2-yl)phenyl]methyl]pyrrolidin-2-yl]methanol;2,2,2-trifluoroacetic acid
CID 53360232
[(2S)-1-anthracen-1-ylpyrrolidin-2-yl]methanol
CID 139951713
[(2S)-1-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-2-yl]methanol
CID 95296940

Frequently Asked Questions

What is the IUPAC name of [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol?
The IUPAC name of [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol (CID 126474399) is [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol is OC[C@@H]1CCCN1c1ccnc2c(-c3cc4ccccc4o3)cnn12.
What is the InChIKey of [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol?
The InChIKey is JDAQAZXWXPVOGK-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-12-14-5-3-9-22(14)18-7-8-20-19-15(11-21-23(18)19)17-10-13-4-1-2-6-16(13)25-17/h1-2,4,6-8,10-11,14,24H,3,5,9,12H2/t14-/m0/s1.
What are the key properties of [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol?
[(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol has a molecular weight of 334.38 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1-[3-(1-benzofuran-2-yl)pyrazolo[1,5-a]pyrimidin-7-yl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 126474399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).