[2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine

C15H27N5 — CID 80656441

IUPAC[2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine
SMILESCCC1(CC)CCN(Cc2nc(C)cc(NN)n2)CC1
InChIInChI=1S/C15H27N5/c1-4-15(5-2)6-8-20(9-7-15)11-14-17-12(3)10-13(18-14)19-16/h10H,4-9,11,16H2,1-3H3,(H,17,18,19)
InChIKeyPVFVXGDTBRYHJX-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.47
Rot. Bonds5

About [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine

[2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine (PubChem CID 80656441) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine
PubChem CID80656441
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name[2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine
SMILESCCC1(CC)CCN(Cc2nc(C)cc(NN)n2)CC1
InChIInChI=1S/C15H27N5/c1-4-15(5-2)6-8-20(9-7-15)11-14-17-12(3)10-13(18-14)19-16/h10H,4-9,11,16H2,1-3H3,(H,17,18,19)
InChIKeyPVFVXGDTBRYHJX-UHFFFAOYSA-N
XLogP2.47
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.47
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-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine (CID 80656441) is [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine is CCC1(CC)CCN(Cc2nc(C)cc(NN)n2)CC1.
What is the InChIKey of [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
The InChIKey is PVFVXGDTBRYHJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-4-15(5-2)6-8-20(9-7-15)11-14-17-12(3)10-13(18-14)19-16/h10H,4-9,11,16H2,1-3H3,(H,17,18,19).
What are the key properties of [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
[2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine has a molecular weight of 277.42 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4,4-diethylpiperidin-1-yl)methyl]-6-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80656441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).