[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine

C12H21N5 — CID 103504775

IUPAC[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine
SMILESCC(C)C1CCN(c2ccnc(NN)n2)CC1
InChIInChI=1S/C12H21N5/c1-9(2)10-4-7-17(8-5-10)11-3-6-14-12(15-11)16-13/h3,6,9-10H,4-5,7-8,13H2,1-2H3,(H,14,15,16)
InChIKeyRWSIWFLLDLFYRF-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.63
Rot. Bonds3

About [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine

[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine (PubChem CID 103504775) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine
PubChem CID103504775
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine
SMILESCC(C)C1CCN(c2ccnc(NN)n2)CC1
InChIInChI=1S/C12H21N5/c1-9(2)10-4-7-17(8-5-10)11-3-6-14-12(15-11)16-13/h3,6,9-10H,4-5,7-8,13H2,1-2H3,(H,14,15,16)
InChIKeyRWSIWFLLDLFYRF-UHFFFAOYSA-N
XLogP1.63
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.63
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 [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine (CID 103504775) is [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine is CC(C)C1CCN(c2ccnc(NN)n2)CC1.
What is the InChIKey of [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine?
The InChIKey is RWSIWFLLDLFYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-9(2)10-4-7-17(8-5-10)11-3-6-14-12(15-11)16-13/h3,6,9-10H,4-5,7-8,13H2,1-2H3,(H,14,15,16).
What are the key properties of [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine?
[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine has a molecular weight of 235.33 g/mol, XLogP of 1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 103504775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).