2-pyrazolidin-1-ylpyrimidine

C7H10N4 — CID 131084968

IUPAC2-pyrazolidin-1-ylpyrimidine
SMILESc1cnc(N2CCCN2)nc1
InChIInChI=1S/C7H10N4/c1-3-8-7(9-4-1)11-6-2-5-10-11/h1,3-4,10H,2,5-6H2
InChIKeyBYBZBDVNUOROQE-UHFFFAOYSA-N
MW150.19 g/mol
LogP0.19
Rot. Bonds1

About 2-pyrazolidin-1-ylpyrimidine

2-pyrazolidin-1-ylpyrimidine (PubChem CID 131084968) has the molecular formula C7H10N4 and a molecular weight of 150.19 g/mol. Its IUPAC name is 2-pyrazolidin-1-ylpyrimidine.

Molecular Properties

Compound Name2-pyrazolidin-1-ylpyrimidine
PubChem CID131084968
Molecular FormulaC7H10N4
Molecular Weight150.19 g/mol
Exact Mass150.09
IUPAC Name2-pyrazolidin-1-ylpyrimidine
SMILESc1cnc(N2CCCN2)nc1
InChIInChI=1S/C7H10N4/c1-3-8-7(9-4-1)11-6-2-5-10-11/h1,3-4,10H,2,5-6H2
InChIKeyBYBZBDVNUOROQE-UHFFFAOYSA-N
XLogP0.19
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.19
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-pyrazolidin-1-ylpyrimidine?
The IUPAC name of 2-pyrazolidin-1-ylpyrimidine (CID 131084968) is 2-pyrazolidin-1-ylpyrimidine.
What is the SMILES notation for 2-pyrazolidin-1-ylpyrimidine?
The canonical SMILES for 2-pyrazolidin-1-ylpyrimidine is c1cnc(N2CCCN2)nc1.
What is the InChIKey of 2-pyrazolidin-1-ylpyrimidine?
The InChIKey is BYBZBDVNUOROQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4/c1-3-8-7(9-4-1)11-6-2-5-10-11/h1,3-4,10H,2,5-6H2.
What are the key properties of 2-pyrazolidin-1-ylpyrimidine?
2-pyrazolidin-1-ylpyrimidine has a molecular weight of 150.19 g/mol, XLogP of 0.19, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazolidin-1-ylpyrimidine is sourced from PubChem (CID 131084968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).