3-methyl-5-(2,4,5-trimethylphenyl)piperidine

C15H23N — CID 115375246

IUPAC3-methyl-5-(2,4,5-trimethylphenyl)piperidine
SMILESCc1cc(C)c(C2CNCC(C)C2)cc1C
InChIInChI=1S/C15H23N/c1-10-5-14(9-16-8-10)15-7-12(3)11(2)6-13(15)4/h6-7,10,14,16H,5,8-9H2,1-4H3
InChIKeyHZYSINOATUZITO-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.32
Rot. Bonds1

About 3-methyl-5-(2,4,5-trimethylphenyl)piperidine

3-methyl-5-(2,4,5-trimethylphenyl)piperidine (PubChem CID 115375246) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3-methyl-5-(2,4,5-trimethylphenyl)piperidine.

Molecular Properties

Compound Name3-methyl-5-(2,4,5-trimethylphenyl)piperidine
PubChem CID115375246
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3-methyl-5-(2,4,5-trimethylphenyl)piperidine
SMILESCc1cc(C)c(C2CNCC(C)C2)cc1C
InChIInChI=1S/C15H23N/c1-10-5-14(9-16-8-10)15-7-12(3)11(2)6-13(15)4/h6-7,10,14,16H,5,8-9H2,1-4H3
InChIKeyHZYSINOATUZITO-UHFFFAOYSA-N
XLogP3.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,4-trimethyl-5-(3-methylcyclobutyl)benzene
CID 123762881
3-(3,5-difluorophenyl)-5-methylpiperidine
CID 115375231
2-methyl-5-(2,4,5-trimethylphenyl)piperidine
CID 64985243
3-(2,3-difluorophenyl)-5-methylpiperidine
CID 115502757
4-ethynyl-5-methyl-10-azatricyclo[6.3.1.02,7]dodeca-2(7),3,5-triene
CID 87994494
5-methyl-3-azabicyclo[5.2.1]decan-10-one
CID 143710984
3-methyl-5-naphthalen-2-ylpiperidine
CID 115375238
3-(3-bromophenyl)-5-methylpiperidine
CID 82381656
3-methyl-5-[2-(trifluoromethoxy)phenyl]piperidine
CID 115375237
azane;3,5-dimethylpiperidine
CID 23174858
N-methyl-N-(2,4,5-trimethylphenyl)azetidin-3-amine
CID 117040590
3-(2,3-dihydro-1-benzofuran-7-yl)-5-methylpiperidine
CID 106781652

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(2,4,5-trimethylphenyl)piperidine?
The IUPAC name of 3-methyl-5-(2,4,5-trimethylphenyl)piperidine (CID 115375246) is 3-methyl-5-(2,4,5-trimethylphenyl)piperidine.
What is the SMILES notation for 3-methyl-5-(2,4,5-trimethylphenyl)piperidine?
The canonical SMILES for 3-methyl-5-(2,4,5-trimethylphenyl)piperidine is Cc1cc(C)c(C2CNCC(C)C2)cc1C.
What is the InChIKey of 3-methyl-5-(2,4,5-trimethylphenyl)piperidine?
The InChIKey is HZYSINOATUZITO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-10-5-14(9-16-8-10)15-7-12(3)11(2)6-13(15)4/h6-7,10,14,16H,5,8-9H2,1-4H3.
What are the key properties of 3-methyl-5-(2,4,5-trimethylphenyl)piperidine?
3-methyl-5-(2,4,5-trimethylphenyl)piperidine has a molecular weight of 217.36 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(2,4,5-trimethylphenyl)piperidine is sourced from PubChem (CID 115375246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).