1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine

C15H24N2 — CID 96660511

IUPAC1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine
SMILESCC[C@H](c1cccc(C)c1C)N1CCNCC1
InChIInChI=1S/C15H24N2/c1-4-15(17-10-8-16-9-11-17)14-7-5-6-12(2)13(14)3/h5-7,15-16H,4,8-11H2,1-3H3/t15-/m1/s1
InChIKeyRCDULNPGLPEHQV-OAHLLOKOSA-N
MW232.37 g/mol
LogP2.66
Rot. Bonds3

About 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine

1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine (PubChem CID 96660511) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine.

Molecular Properties

Compound Name1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine
PubChem CID96660511
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine
SMILESCC[C@H](c1cccc(C)c1C)N1CCNCC1
InChIInChI=1S/C15H24N2/c1-4-15(17-10-8-16-9-11-17)14-7-5-6-12(2)13(14)3/h5-7,15-16H,4,8-11H2,1-3H3/t15-/m1/s1
InChIKeyRCDULNPGLPEHQV-OAHLLOKOSA-N
XLogP2.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1R)-1-(2-methylphenyl)propyl]piperazine
CID 92754595
1-[(1S)-1-(2,3-dimethylphenyl)-2-fluoroethyl]piperazine;hydrochloride
CID 171181800
1-[(1R)-1-(2,3-dimethylphenyl)pentyl]piperazine
CID 171307626
1-[(1R)-1-(2,3-dimethylphenyl)-3,3,3-trifluoropropyl]piperazine
CID 171169153
1-[(1S)-1-(2,3-dimethylphenyl)-4,4,4-trifluorobutyl]piperazine
CID 171164319
1-[(1S)-1-(2,3-dimethylphenyl)but-3-enyl]piperazine
CID 171275803
1-[(1R)-1-(2,3-dimethylphenyl)-3-methylbut-3-enyl]piperazine;dihydrochloride
CID 171288458
1-[(1S)-1-(2,3-difluorophenyl)propyl]piperazine
CID 171164114
1-[(1R)-1-(2-chlorophenyl)propyl]piperazine
CID 92754288
1-[(1R)-1-(2,3-dimethylphenyl)prop-2-enyl]piperazine;dihydrochloride
CID 171288426
1-[(1R)-1-(2-ethoxyphenyl)propyl]piperazine;dihydrochloride
CID 171288177
2-chloro-6-[(1S)-1-piperazin-1-ylpropyl]phenol
CID 171277444

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine?
The IUPAC name of 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine (CID 96660511) is 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine.
What is the SMILES notation for 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine?
The canonical SMILES for 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine is CC[C@H](c1cccc(C)c1C)N1CCNCC1.
What is the InChIKey of 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine?
The InChIKey is RCDULNPGLPEHQV-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-15(17-10-8-16-9-11-17)14-7-5-6-12(2)13(14)3/h5-7,15-16H,4,8-11H2,1-3H3/t15-/m1/s1.
What are the key properties of 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine?
1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine has a molecular weight of 232.37 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(2,3-dimethylphenyl)propyl]piperazine is sourced from PubChem (CID 96660511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).