1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine

C15H23NO — CID 142233666

IUPAC1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine
SMILESCOc1c(C)cccc1CN1CCC(C)CC1
InChIInChI=1S/C15H23NO/c1-12-7-9-16(10-8-12)11-14-6-4-5-13(2)15(14)17-3/h4-6,12H,7-11H2,1-3H3
InChIKeySMVOVKZYDCNZDQ-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.24
Rot. Bonds3

About 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine

1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine (PubChem CID 142233666) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine.

Molecular Properties

Compound Name1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine
PubChem CID142233666
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine
SMILESCOc1c(C)cccc1CN1CCC(C)CC1
InChIInChI=1S/C15H23NO/c1-12-7-9-16(10-8-12)11-14-6-4-5-13(2)15(14)17-3/h4-6,12H,7-11H2,1-3H3
InChIKeySMVOVKZYDCNZDQ-UHFFFAOYSA-N
XLogP3.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2,3-dimethoxyphenyl)methyl]-4-(4-methylpiperidin-1-yl)piperidine;oxalic acid
CID 2910657
1-[(4-methoxy-2,5-dimethylphenyl)methyl]-4-methylpiperidine
CID 2846019
1-[(3-fluoro-2-methoxyphenyl)methyl]piperidin-4-amine
CID 167713391
2-methoxy-6-[(4-methylpiperidin-1-yl)methyl]phenol;oxalic acid
CID 163328183
3-methyl-1-(naphthalen-1-ylmethyl)pyrrolidine
CID 23396966
1-[(2-methylphenyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine
CID 1126216
1-[(2,3-dimethoxyphenyl)methyl]-4-[(2-methylphenyl)methyl]piperazine;oxalic acid
CID 17366969
2-(4-methylphenyl)-N-[[2-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]acetamide
CID 46469858
2-methyl-N-[[2-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]benzamide
CID 46476891
1-[(2,3-dimethoxyphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 113281872
1-(2,6-dimethylphenoxy)-3-(4-methylpiperidin-1-yl)propan-2-ol chloride
CID 21237803
2-[3-[(3S)-1-[(2-methoxy-3-methylphenyl)methyl]pyrrolidin-3-yl]pyrazolo[3,4-b]pyridin-1-yl]ethanamine
CID 92561368

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine?
The IUPAC name of 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine (CID 142233666) is 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine.
What is the SMILES notation for 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine?
The canonical SMILES for 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine is COc1c(C)cccc1CN1CCC(C)CC1.
What is the InChIKey of 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine?
The InChIKey is SMVOVKZYDCNZDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-7-9-16(10-8-12)11-14-6-4-5-13(2)15(14)17-3/h4-6,12H,7-11H2,1-3H3.
What are the key properties of 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine?
1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine has a molecular weight of 233.35 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methoxy-3-methylphenyl)methyl]-4-methylpiperidine is sourced from PubChem (CID 142233666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).