(2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine

C8H11FN4 — CID 142155045

IUPAC(2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine
SMILESNNc1nc(F)nc2c1CCCC2
InChIInChI=1S/C8H11FN4/c9-8-11-6-4-2-1-3-5(6)7(12-8)13-10/h1-4,10H2,(H,11,12,13)
InChIKeyCGNSILMKDADSPQ-UHFFFAOYSA-N
MW182.20 g/mol
LogP0.78
Rot. Bonds1

About (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine

(2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine (PubChem CID 142155045) has the molecular formula C8H11FN4 and a molecular weight of 182.20 g/mol. Its IUPAC name is (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine
PubChem CID142155045
Molecular FormulaC8H11FN4
Molecular Weight182.20 g/mol
Exact Mass182.10
IUPAC Name(2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine
SMILESNNc1nc(F)nc2c1CCCC2
InChIInChI=1S/C8H11FN4/c9-8-11-6-4-2-1-3-5(6)7(12-8)13-10/h1-4,10H2,(H,11,12,13)
InChIKeyCGNSILMKDADSPQ-UHFFFAOYSA-N
XLogP0.78
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine?
The IUPAC name of (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine (CID 142155045) is (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine.
What is the SMILES notation for (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine?
The canonical SMILES for (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine is NNc1nc(F)nc2c1CCCC2.
What is the InChIKey of (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine?
The InChIKey is CGNSILMKDADSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN4/c9-8-11-6-4-2-1-3-5(6)7(12-8)13-10/h1-4,10H2,(H,11,12,13).
What are the key properties of (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine?
(2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine has a molecular weight of 182.20 g/mol, XLogP of 0.78, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-5,6,7,8-tetrahydroquinazolin-4-yl)hydrazine is sourced from PubChem (CID 142155045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).