3-methyl-1-(2-phenylpropyl)piperazine

C14H22N2 — CID 65416584

IUPAC3-methyl-1-(2-phenylpropyl)piperazine
SMILESCC1CN(CC(C)c2ccccc2)CCN1
InChIInChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)10-16-9-8-15-13(2)11-16/h3-7,12-13,15H,8-11H2,1-2H3
InChIKeyROQYTECQZSRJNP-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.08
Rot. Bonds3

About 3-methyl-1-(2-phenylpropyl)piperazine

3-methyl-1-(2-phenylpropyl)piperazine (PubChem CID 65416584) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 3-methyl-1-(2-phenylpropyl)piperazine.

Molecular Properties

Compound Name3-methyl-1-(2-phenylpropyl)piperazine
PubChem CID65416584
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name3-methyl-1-(2-phenylpropyl)piperazine
SMILESCC1CN(CC(C)c2ccccc2)CCN1
InChIInChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)10-16-9-8-15-13(2)11-16/h3-7,12-13,15H,8-11H2,1-2H3
InChIKeyROQYTECQZSRJNP-UHFFFAOYSA-N
XLogP2.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-(2-phenylpropyl)piperidin-4-amine
CID 79879108
3-butan-2-yl-1-(2-phenylpropyl)-1,4-diazepane
CID 104592353
benzyl 2-methyl-3-(3-methylpiperazin-1-yl)propanoate
CID 106484436
benzyl 2-methyl-3-[(3R)-3-methylpiperazin-1-yl]propanoate
CID 106484459
1-(2-phenylpropyl)-3-pyrrolidin-2-ylpiperidine
CID 61101148
6-ethyl-3-methyl-1-(2-phenylpropyl)-1,5-diazocane
CID 104592186
2-(3-methylpiperazin-1-yl)-N-(1-phenylethyl)acetamide
CID 65448844
(3S)-1-benzyl-3-methylpiperazine;hydrochloride
CID 52982949
1-benzyl-3-methylpiperazine;ethane
CID 166543639
1-(2-phenylpropyl)azetidin-3-ol
CID 121200321
(3S)-3-methyl-1-(2-phenylethyl)piperazine
CID 95243884
3-methyl-1-(1-phenylethyl)piperazine;hydrochloride
CID 119924296

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2-phenylpropyl)piperazine?
The IUPAC name of 3-methyl-1-(2-phenylpropyl)piperazine (CID 65416584) is 3-methyl-1-(2-phenylpropyl)piperazine.
What is the SMILES notation for 3-methyl-1-(2-phenylpropyl)piperazine?
The canonical SMILES for 3-methyl-1-(2-phenylpropyl)piperazine is CC1CN(CC(C)c2ccccc2)CCN1.
What is the InChIKey of 3-methyl-1-(2-phenylpropyl)piperazine?
The InChIKey is ROQYTECQZSRJNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)10-16-9-8-15-13(2)11-16/h3-7,12-13,15H,8-11H2,1-2H3.
What are the key properties of 3-methyl-1-(2-phenylpropyl)piperazine?
3-methyl-1-(2-phenylpropyl)piperazine has a molecular weight of 218.34 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2-phenylpropyl)piperazine is sourced from PubChem (CID 65416584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).