[4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol

C15H23NO — CID 82082899

IUPAC[4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol
SMILESCc1ccc(C)c(C2(CO)CCN(C)CC2)c1
InChIInChI=1S/C15H23NO/c1-12-4-5-13(2)14(10-12)15(11-17)6-8-16(3)9-7-15/h4-5,10,17H,6-9,11H2,1-3H3
InChIKeyRBYIGEZFXBHGRQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.26
Rot. Bonds2

About [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol

[4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol (PubChem CID 82082899) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol.

Molecular Properties

Compound Name[4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol
PubChem CID82082899
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name[4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol
SMILESCc1ccc(C)c(C2(CO)CCN(C)CC2)c1
InChIInChI=1S/C15H23NO/c1-12-4-5-13(2)14(10-12)15(11-17)6-8-16(3)9-7-15/h4-5,10,17H,6-9,11H2,1-3H3
InChIKeyRBYIGEZFXBHGRQ-UHFFFAOYSA-N
XLogP2.26
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-methyl-4-(4-methylphenyl)piperidin-4-yl]ethanol
CID 121451603
[1-cyclopropyl-4-(2,5-dimethylphenyl)piperidin-4-yl]methanamine
CID 82300752
[4-(5-fluoro-2-methoxyphenyl)-1-methylpiperidin-4-yl]methanol
CID 82088194
[1-(2,5-dimethylphenyl)cyclopentyl]methanamine
CID 82491829
3-(2,5-dimethylphenyl)-1-ethylpyrrolidin-3-ol
CID 165403438
1-(2,5-dimethylphenyl)cycloheptan-1-ol
CID 62548506
1-[4-(2,4-dimethylphenyl)-1-methylpiperidin-4-yl]ethanone
CID 82294883
1-[1-(2,5-dimethylphenyl)cyclopentyl]-N-methylmethanamine
CID 82471973
3-[(2,5-dimethylphenyl)methyl]-1-methylpyrrolidin-3-ol
CID 62977270
2-[1-(5-fluoro-2-methylphenyl)cyclopropyl]acetic acid
CID 84780127
1-(2,5-dimethylphenyl)-4-(hydroxymethyl)piperidin-4-ol
CID 143566862
1-(2,5-dimethylphenyl)cyclobutane-1-carboxylic acid
CID 82609045

Frequently Asked Questions

What is the IUPAC name of [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol?
The IUPAC name of [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol (CID 82082899) is [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol.
What is the SMILES notation for [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol?
The canonical SMILES for [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol is Cc1ccc(C)c(C2(CO)CCN(C)CC2)c1.
What is the InChIKey of [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol?
The InChIKey is RBYIGEZFXBHGRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-4-5-13(2)14(10-12)15(11-17)6-8-16(3)9-7-15/h4-5,10,17H,6-9,11H2,1-3H3.
What are the key properties of [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol?
[4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol has a molecular weight of 233.36 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,5-dimethylphenyl)-1-methylpiperidin-4-yl]methanol is sourced from PubChem (CID 82082899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).