4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine

C15H24N4 — CID 110271259

IUPAC4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine
SMILESc1nc(CCC2CCCCN2)cc(N2CCCC2)n1
InChIInChI=1S/C15H24N4/c1-2-8-16-13(5-1)6-7-14-11-15(18-12-17-14)19-9-3-4-10-19/h11-13,16H,1-10H2
InChIKeyMVCXZMKIUVMJBW-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.15
Rot. Bonds4

About 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine

4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine (PubChem CID 110271259) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine.

Molecular Properties

Compound Name4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine
PubChem CID110271259
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine
SMILESc1nc(CCC2CCCCN2)cc(N2CCCC2)n1
InChIInChI=1S/C15H24N4/c1-2-8-16-13(5-1)6-7-14-11-15(18-12-17-14)19-9-3-4-10-19/h11-13,16H,1-10H2
InChIKeyMVCXZMKIUVMJBW-UHFFFAOYSA-N
XLogP2.15
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine?
The IUPAC name of 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine (CID 110271259) is 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine.
What is the SMILES notation for 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine?
The canonical SMILES for 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine is c1nc(CCC2CCCCN2)cc(N2CCCC2)n1.
What is the InChIKey of 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine?
The InChIKey is MVCXZMKIUVMJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-2-8-16-13(5-1)6-7-14-11-15(18-12-17-14)19-9-3-4-10-19/h11-13,16H,1-10H2.
What are the key properties of 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine?
4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine has a molecular weight of 260.38 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-piperidin-2-ylethyl)-6-pyrrolidin-1-ylpyrimidine is sourced from PubChem (CID 110271259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).