[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine

C11H19N5 — CID 80932713

IUPAC[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine
SMILESNNc1nccc(N2CCCCCCC2)n1
InChIInChI=1S/C11H19N5/c12-15-11-13-7-6-10(14-11)16-8-4-2-1-3-5-9-16/h6-7H,1-5,8-9,12H2,(H,13,14,15)
InChIKeyCYNDVVZLURNJED-UHFFFAOYSA-N
MW221.31 g/mol
LogP1.53
Rot. Bonds2

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

[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine (PubChem CID 80932713) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine
PubChem CID80932713
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC Name[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine
SMILESNNc1nccc(N2CCCCCCC2)n1
InChIInChI=1S/C11H19N5/c12-15-11-13-7-6-10(14-11)16-8-4-2-1-3-5-9-16/h6-7H,1-5,8-9,12H2,(H,13,14,15)
InChIKeyCYNDVVZLURNJED-UHFFFAOYSA-N
XLogP1.53
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 51.53
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-(azocan-1-yl)pyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine (CID 80932713) is [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine is NNc1nccc(N2CCCCCCC2)n1.
What is the InChIKey of [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine?
The InChIKey is CYNDVVZLURNJED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c12-15-11-13-7-6-10(14-11)16-8-4-2-1-3-5-9-16/h6-7H,1-5,8-9,12H2,(H,13,14,15).
What are the key properties of [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine?
[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine has a molecular weight of 221.31 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(azocan-1-yl)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80932713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).