3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol

C10H13N5O — CID 79816597

IUPAC3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol
SMILESNc1c(CCCO)cnn1-c1ccncn1
InChIInChI=1S/C10H13N5O/c11-10-8(2-1-5-16)6-14-15(10)9-3-4-12-7-13-9/h3-4,6-7,16H,1-2,5,11H2
InChIKeyGYJREYNRJAJUNL-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.17
Rot. Bonds4

About 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol

3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol (PubChem CID 79816597) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol
PubChem CID79816597
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol
SMILESNc1c(CCCO)cnn1-c1ccncn1
InChIInChI=1S/C10H13N5O/c11-10-8(2-1-5-16)6-14-15(10)9-3-4-12-7-13-9/h3-4,6-7,16H,1-2,5,11H2
InChIKeyGYJREYNRJAJUNL-UHFFFAOYSA-N
XLogP0.17
TPSA89.85 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol 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 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol?
The IUPAC name of 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol (CID 79816597) is 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol.
What is the SMILES notation for 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol?
The canonical SMILES for 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol is Nc1c(CCCO)cnn1-c1ccncn1.
What is the InChIKey of 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol?
The InChIKey is GYJREYNRJAJUNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c11-10-8(2-1-5-16)6-14-15(10)9-3-4-12-7-13-9/h3-4,6-7,16H,1-2,5,11H2.
What are the key properties of 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol?
3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol has a molecular weight of 219.25 g/mol, XLogP of 0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-amino-1-pyrimidin-4-ylpyrazol-4-yl)propan-1-ol is sourced from PubChem (CID 79816597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).