[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine

C16H20N4O — CID 104611798

IUPAC[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine
SMILESCOC1(c2nc(NN)cc(-c3ccccc3)n2)CCCC1
InChIInChI=1S/C16H20N4O/c1-21-16(9-5-6-10-16)15-18-13(11-14(19-15)20-17)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10,17H2,1H3,(H,18,19,20)
InChIKeyHZPLIAMPPJWTKO-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.84
Rot. Bonds4

About [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine

[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine (PubChem CID 104611798) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine
PubChem CID104611798
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine
SMILESCOC1(c2nc(NN)cc(-c3ccccc3)n2)CCCC1
InChIInChI=1S/C16H20N4O/c1-21-16(9-5-6-10-16)15-18-13(11-14(19-15)20-17)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10,17H2,1H3,(H,18,19,20)
InChIKeyHZPLIAMPPJWTKO-UHFFFAOYSA-N
XLogP2.84
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.84
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-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine (CID 104611798) is [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine is COC1(c2nc(NN)cc(-c3ccccc3)n2)CCCC1.
What is the InChIKey of [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine?
The InChIKey is HZPLIAMPPJWTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-21-16(9-5-6-10-16)15-18-13(11-14(19-15)20-17)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10,17H2,1H3,(H,18,19,20).
What are the key properties of [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine?
[2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine has a molecular weight of 284.36 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-methoxycyclopentyl)-6-phenylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 104611798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).