[5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine

C16H20N4 — CID 63250464

IUPAC[5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(C2CCCc3ccccc32)nc(NN)c1C
InChIInChI=1S/C16H20N4/c1-10-11(2)18-16(19-15(10)20-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-4,6,8,14H,5,7,9,17H2,1-2H3,(H,18,19,20)
InChIKeyYJHMXBLHJFHQGN-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.85
Rot. Bonds2

About [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine

[5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine (PubChem CID 63250464) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine
PubChem CID63250464
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name[5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(C2CCCc3ccccc32)nc(NN)c1C
InChIInChI=1S/C16H20N4/c1-10-11(2)18-16(19-15(10)20-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-4,6,8,14H,5,7,9,17H2,1-2H3,(H,18,19,20)
InChIKeyYJHMXBLHJFHQGN-UHFFFAOYSA-N
XLogP2.85
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.85
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 [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine (CID 63250464) is [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine is Cc1nc(C2CCCc3ccccc32)nc(NN)c1C.
What is the InChIKey of [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine?
The InChIKey is YJHMXBLHJFHQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-10-11(2)18-16(19-15(10)20-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-4,6,8,14H,5,7,9,17H2,1-2H3,(H,18,19,20).
What are the key properties of [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine?
[5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine has a molecular weight of 268.36 g/mol, XLogP of 2.85, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5,6-dimethyl-2-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63250464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).