acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol

C15H18N6O3 — CID 166599371

IUPACacetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
SMILESCC(=O)O.OC1CCN(c2nccn3c(-c4cn[nH]c4)cnc23)C1
InChIInChI=1S/C13H14N6O.C2H4O2/c20-10-1-3-18(8-10)12-13-15-7-11(9-5-16-17-6-9)19(13)4-2-14-12;1-2(3)4/h2,4-7,10,20H,1,3,8H2,(H,16,17);1H3,(H,3,4)
InChIKeyUMJMAJHWUQYEJN-UHFFFAOYSA-N
MW330.35 g/mol
LogP0.78
Rot. Bonds2

About acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol

acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol (PubChem CID 166599371) has the molecular formula C15H18N6O3 and a molecular weight of 330.35 g/mol. Its IUPAC name is acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol.

Molecular Properties

Compound Nameacetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
PubChem CID166599371
Molecular FormulaC15H18N6O3
Molecular Weight330.35 g/mol
Exact Mass330.14
IUPAC Nameacetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
SMILESCC(=O)O.OC1CCN(c2nccn3c(-c4cn[nH]c4)cnc23)C1
InChIInChI=1S/C13H14N6O.C2H4O2/c20-10-1-3-18(8-10)12-13-15-7-11(9-5-16-17-6-9)19(13)4-2-14-12;1-2(3)4/h2,4-7,10,20H,1,3,8H2,(H,16,17);1H3,(H,3,4)
InChIKeyUMJMAJHWUQYEJN-UHFFFAOYSA-N
XLogP0.78
TPSA119.64 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol 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

1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
CID 163317288
3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine
CID 143460544
3-[(3R)-3-hydroxypyrrolidin-1-yl]-1-methylpyrazin-2-one
CID 103696647
1-[3-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
CID 163310971
8-methyl-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazine;4-methylpyridine
CID 143461052
1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
CID 163305995
1-[4-(1H-pyrazol-4-yl)phenyl]piperidine-4-carboxylic acid
CID 69133100
1-(3-pyrazolo[1,5-a]pyridin-7-ylimidazo[1,2-a]pyrazin-8-yl)piperidin-4-ol
CID 163317910
1-[3-(2-methoxyquinolin-3-yl)imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
CID 163313692
6-[[5-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]pyridine-3-carboxamide
CID 24856770
3-(1H-pyrazol-4-yl)-8-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazine
CID 143465022
3-(3-hydroxypiperidin-1-yl)-1-methylpyrazin-2-one
CID 62940622

Frequently Asked Questions

What is the IUPAC name of acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
The IUPAC name of acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol (CID 166599371) is acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol.
What is the SMILES notation for acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
The canonical SMILES for acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol is CC(=O)O.OC1CCN(c2nccn3c(-c4cn[nH]c4)cnc23)C1.
What is the InChIKey of acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
The InChIKey is UMJMAJHWUQYEJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6O.C2H4O2/c20-10-1-3-18(8-10)12-13-15-7-11(9-5-16-17-6-9)19(13)4-2-14-12;1-2(3)4/h2,4-7,10,20H,1,3,8H2,(H,16,17);1H3,(H,3,4).
What are the key properties of acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol has a molecular weight of 330.35 g/mol, XLogP of 0.78, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol is sourced from PubChem (CID 166599371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).