6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine

C12H22N6 — CID 83027793

IUPAC6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(NN)cc(NN2CCCCC2)n1
InChIInChI=1S/C12H22N6/c1-9(2)12-14-10(16-13)8-11(15-12)17-18-6-4-3-5-7-18/h8-9H,3-7,13H2,1-2H3,(H2,14,15,16,17)
InChIKeyIDRYLYQOVCGVAO-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.70
Rot. Bonds4

About 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine

6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 83027793) has the molecular formula C12H22N6 and a molecular weight of 250.35 g/mol. Its IUPAC name is 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine
PubChem CID83027793
Molecular FormulaC12H22N6
Molecular Weight250.35 g/mol
Exact Mass250.19
IUPAC Name6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(NN)cc(NN2CCCCC2)n1
InChIInChI=1S/C12H22N6/c1-9(2)12-14-10(16-13)8-11(15-12)17-18-6-4-3-5-7-18/h8-9H,3-7,13H2,1-2H3,(H2,14,15,16,17)
InChIKeyIDRYLYQOVCGVAO-UHFFFAOYSA-N
XLogP1.70
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.70
H-Bond Donors ≤ 53
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 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine (CID 83027793) is 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine is CC(C)c1nc(NN)cc(NN2CCCCC2)n1.
What is the InChIKey of 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is IDRYLYQOVCGVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6/c1-9(2)12-14-10(16-13)8-11(15-12)17-18-6-4-3-5-7-18/h8-9H,3-7,13H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine?
6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.70, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-piperidin-1-yl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 83027793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).