2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine

C15H25N5 — CID 102273193

IUPAC2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine
SMILESc1cnc(N2CCN(CCN3CCCCC3)CC2)nc1
InChIInChI=1S/C15H25N5/c1-2-7-18(8-3-1)9-10-19-11-13-20(14-12-19)15-16-5-4-6-17-15/h4-6H,1-3,7-14H2
InChIKeyPNSLIBIQFVMLOZ-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.08
Rot. Bonds4

About 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine

2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine (PubChem CID 102273193) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine.

Molecular Properties

Compound Name2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine
PubChem CID102273193
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine
SMILESc1cnc(N2CCN(CCN3CCCCC3)CC2)nc1
InChIInChI=1S/C15H25N5/c1-2-7-18(8-3-1)9-10-19-11-13-20(14-12-19)15-16-5-4-6-17-15/h4-6H,1-3,7-14H2
InChIKeyPNSLIBIQFVMLOZ-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine;dihydrochloride
CID 46736988
N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]piperidine-1-sulfonamide
CID 37302509
N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentanamine
CID 60849987
2-[4-[2-[3,3-bis(4-fluorophenyl)piperidin-1-yl]ethyl]piperazin-1-yl]pyrimidine
CID 67376413
1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]piperidin-2-one
CID 10358464
N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]prop-2-yn-1-amine
CID 62575755
N-propan-2-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-amine
CID 60853273
2-[4-(3-methoxypropyl)piperazin-1-yl]pyrimidine
CID 171069544
2-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]cyclopentan-1-amine
CID 79569923
1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrrolidin-1-ylethanone
CID 110688001
5-(4-pyrimidin-2-ylpiperazin-1-yl)pentanoic acid
CID 28972374
2-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]propan-2-amine
CID 55070558

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine?
The IUPAC name of 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine (CID 102273193) is 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine.
What is the SMILES notation for 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine?
The canonical SMILES for 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine is c1cnc(N2CCN(CCN3CCCCC3)CC2)nc1.
What is the InChIKey of 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine?
The InChIKey is PNSLIBIQFVMLOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-2-7-18(8-3-1)9-10-19-11-13-20(14-12-19)15-16-5-4-6-17-15/h4-6H,1-3,7-14H2.
What are the key properties of 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine?
2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine has a molecular weight of 275.40 g/mol, XLogP of 1.08, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]pyrimidine is sourced from PubChem (CID 102273193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).