3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine

C18H23N3 — CID 64923711

IUPAC3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine
SMILESCC1(c2ccccc2)CN(CCc2ccccn2)CCN1
InChIInChI=1S/C18H23N3/c1-18(16-7-3-2-4-8-16)15-21(14-12-20-18)13-10-17-9-5-6-11-19-17/h2-9,11,20H,10,12-15H2,1H3
InChIKeyFRFKJPVOYZLTTA-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.44
Rot. Bonds4

About 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine

3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine (PubChem CID 64923711) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine.

Molecular Properties

Compound Name3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine
PubChem CID64923711
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine
SMILESCC1(c2ccccc2)CN(CCc2ccccn2)CCN1
InChIInChI=1S/C18H23N3/c1-18(16-7-3-2-4-8-16)15-21(14-12-20-18)13-10-17-9-5-6-11-19-17/h2-9,11,20H,10,12-15H2,1H3
InChIKeyFRFKJPVOYZLTTA-UHFFFAOYSA-N
XLogP2.44
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,3-dimethyl-1-(2-pyridin-2-ylethyl)-1,4-diazepane
CID 64942804
3-methyl-1-(2-methylsulfanylethyl)-3-phenylpiperazine
CID 64954623
5-methyl-3-[2-(3-methyl-3-phenylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole
CID 106421440
3-methyl-1-(4-methylpentyl)-3-phenylpiperazine
CID 64952596
3-methyl-1-(2-methylsulfonylethyl)-3-phenylpiperazine
CID 64831695
3-methyl-1-[(1-methylpyrazol-3-yl)methyl]-3-phenylpiperazine
CID 82870528
1-(2,2-dimethylpropyl)-3-methyl-3-phenylpiperazine
CID 64925313
4-methyl-1-(2-pyridin-2-ylethyl)piperidin-4-ol
CID 80702351
1-(2-pyridin-2-ylethyl)-1,4-diazepane
CID 8022497
1-[2-(furan-2-yl)ethyl]-3-methyl-3-phenyl-1,4-diazepane
CID 64944603
1-[(4-bromophenyl)methyl]-3-methyl-3-phenylpiperazine
CID 64832086
5-[(3-methyl-3-phenylpiperazin-1-yl)methyl]-1,3-thiazole
CID 112644804

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine?
The IUPAC name of 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine (CID 64923711) is 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine.
What is the SMILES notation for 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine?
The canonical SMILES for 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine is CC1(c2ccccc2)CN(CCc2ccccn2)CCN1.
What is the InChIKey of 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine?
The InChIKey is FRFKJPVOYZLTTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-18(16-7-3-2-4-8-16)15-21(14-12-20-18)13-10-17-9-5-6-11-19-17/h2-9,11,20H,10,12-15H2,1H3.
What are the key properties of 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine?
3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine has a molecular weight of 281.40 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-phenyl-1-(2-pyridin-2-ylethyl)piperazine is sourced from PubChem (CID 64923711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).