1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine

C18H23N3 — CID 171337954

IUPAC1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine
SMILESCc1ccc(N2CCN(CCc3ccccc3)CC2)nc1
InChIInChI=1S/C18H23N3/c1-16-7-8-18(19-15-16)21-13-11-20(12-14-21)10-9-17-5-3-2-4-6-17/h2-8,15H,9-14H2,1H3
InChIKeyFZIIWFUQPCTEQE-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.75
Rot. Bonds4

About 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine

1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine (PubChem CID 171337954) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine.

Molecular Properties

Compound Name1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine
PubChem CID171337954
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine
SMILESCc1ccc(N2CCN(CCc3ccccc3)CC2)nc1
InChIInChI=1S/C18H23N3/c1-16-7-8-18(19-15-16)21-13-11-20(12-14-21)10-9-17-5-3-2-4-6-17/h2-8,15H,9-14H2,1H3
InChIKeyFZIIWFUQPCTEQE-UHFFFAOYSA-N
XLogP2.75
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-4-[4-(2-phenylethyl)piperazin-1-yl]pyrimidine
CID 171335725
1-(5-methyl-2-pyridinyl)-4-(2-methylsulfanylethyl)piperazine
CID 143774965
4-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]butan-1-amine
CID 43252517
1-(6-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine
CID 133313558
4-[5-[[4-(2-phenylethyl)piperazin-1-yl]methyl]-2-pyridinyl]morpholine
CID 24784906
4-(4-methylpyrazol-1-yl)-6-[4-(2-phenylethyl)piperazin-1-yl]pyrimidine
CID 154829313
4-benzyl-1-(5-methyl-2-pyridinyl)-1,4-diazepan-5-one
CID 91370929
3-methyl-5-[4-(2-phenylethyl)piperazin-1-yl]imidazo[4,5-b]pyridine
CID 71321562
1-benzyl-4-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]phthalazine
CID 123615357
2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
CID 59676617
4-[6-[4-(2-phenylethyl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 122282526
N-[1-(5-methyl-2-pyridinyl)piperidin-4-yl]-3-(4-phenylpiperazin-1-yl)propanamide
CID 91026152

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine?
The IUPAC name of 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine (CID 171337954) is 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine.
What is the SMILES notation for 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine?
The canonical SMILES for 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine is Cc1ccc(N2CCN(CCc3ccccc3)CC2)nc1.
What is the InChIKey of 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine?
The InChIKey is FZIIWFUQPCTEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-16-7-8-18(19-15-16)21-13-11-20(12-14-21)10-9-17-5-3-2-4-6-17/h2-8,15H,9-14H2,1H3.
What are the key properties of 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine?
1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine has a molecular weight of 281.40 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-2-pyridinyl)-4-(2-phenylethyl)piperazine is sourced from PubChem (CID 171337954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).