1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine

C12H22N6 — CID 80904477

IUPAC1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine
SMILESCN(C)CC1CCN(c2ccnc(NN)n2)CC1
InChIInChI=1S/C12H22N6/c1-17(2)9-10-4-7-18(8-5-10)11-3-6-14-12(15-11)16-13/h3,6,10H,4-5,7-9,13H2,1-2H3,(H,14,15,16)
InChIKeyGULKMXWOQNQEJQ-UHFFFAOYSA-N
MW250.35 g/mol
LogP0.54
Rot. Bonds4

About 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine

1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine (PubChem CID 80904477) has the molecular formula C12H22N6 and a molecular weight of 250.35 g/mol. Its IUPAC name is 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine
PubChem CID80904477
Molecular FormulaC12H22N6
Molecular Weight250.35 g/mol
Exact Mass250.19
IUPAC Name1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine
SMILESCN(C)CC1CCN(c2ccnc(NN)n2)CC1
InChIInChI=1S/C12H22N6/c1-17(2)9-10-4-7-18(8-5-10)11-3-6-14-12(15-11)16-13/h3,6,10H,4-5,7-9,13H2,1-2H3,(H,14,15,16)
InChIKeyGULKMXWOQNQEJQ-UHFFFAOYSA-N
XLogP0.54
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine (CID 80904477) is 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine is CN(C)CC1CCN(c2ccnc(NN)n2)CC1.
What is the InChIKey of 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
The InChIKey is GULKMXWOQNQEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6/c1-17(2)9-10-4-7-18(8-5-10)11-3-6-14-12(15-11)16-13/h3,6,10H,4-5,7-9,13H2,1-2H3,(H,14,15,16).
What are the key properties of 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine?
1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine has a molecular weight of 250.35 g/mol, XLogP of 0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 80904477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).