(2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine

C13H11N5 — CID 67040292

IUPAC(2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine
SMILESNNc1ccccc1-c1ncc2ncccc2n1
InChIInChI=1S/C13H11N5/c14-18-10-5-2-1-4-9(10)13-16-8-12-11(17-13)6-3-7-15-12/h1-8,18H,14H2
InChIKeyCGVNYFAKRLRIPY-UHFFFAOYSA-N
MW237.27 g/mol
LogP1.98
Rot. Bonds2

About (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine

(2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine (PubChem CID 67040292) has the molecular formula C13H11N5 and a molecular weight of 237.27 g/mol. Its IUPAC name is (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine.

Molecular Properties

Compound Name(2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine
PubChem CID67040292
Molecular FormulaC13H11N5
Molecular Weight237.27 g/mol
Exact Mass237.10
IUPAC Name(2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine
SMILESNNc1ccccc1-c1ncc2ncccc2n1
InChIInChI=1S/C13H11N5/c14-18-10-5-2-1-4-9(10)13-16-8-12-11(17-13)6-3-7-15-12/h1-8,18H,14H2
InChIKeyCGVNYFAKRLRIPY-UHFFFAOYSA-N
XLogP1.98
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine?
The IUPAC name of (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine (CID 67040292) is (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine.
What is the SMILES notation for (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine?
The canonical SMILES for (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine is NNc1ccccc1-c1ncc2ncccc2n1.
What is the InChIKey of (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine?
The InChIKey is CGVNYFAKRLRIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5/c14-18-10-5-2-1-4-9(10)13-16-8-12-11(17-13)6-3-7-15-12/h1-8,18H,14H2.
What are the key properties of (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine?
(2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine has a molecular weight of 237.27 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pyrido[3,2-d]pyrimidin-2-ylphenyl)hydrazine is sourced from PubChem (CID 67040292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).