5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine

C10H13ClN4O — CID 134792062

IUPAC5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCOCCNc1cc(Cl)nc2ccnn12
InChIInChI=1S/C10H13ClN4O/c1-2-16-6-5-12-10-7-8(11)14-9-3-4-13-15(9)10/h3-4,7,12H,2,5-6H2,1H3
InChIKeyVQHJCCRESKUJLL-UHFFFAOYSA-N
MW240.69 g/mol
LogP1.83
Rot. Bonds5

About 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine

5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 134792062) has the molecular formula C10H13ClN4O and a molecular weight of 240.69 g/mol. Its IUPAC name is 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID134792062
Molecular FormulaC10H13ClN4O
Molecular Weight240.69 g/mol
Exact Mass240.08
IUPAC Name5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCOCCNc1cc(Cl)nc2ccnn12
InChIInChI=1S/C10H13ClN4O/c1-2-16-6-5-12-10-7-8(11)14-9-3-4-13-15(9)10/h3-4,7,12H,2,5-6H2,1H3
InChIKeyVQHJCCRESKUJLL-UHFFFAOYSA-N
XLogP1.83
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.69
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine 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 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 134792062) is 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine is CCOCCNc1cc(Cl)nc2ccnn12.
What is the InChIKey of 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is VQHJCCRESKUJLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN4O/c1-2-16-6-5-12-10-7-8(11)14-9-3-4-13-15(9)10/h3-4,7,12H,2,5-6H2,1H3.
What are the key properties of 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 240.69 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-ethoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 134792062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).