2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol

C15H23NO — CID 117003508

IUPAC2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol
SMILESCc1ccc(C)c(N2CCC(CCO)CC2)c1
InChIInChI=1S/C15H23NO/c1-12-3-4-13(2)15(11-12)16-8-5-14(6-9-16)7-10-17/h3-4,11,14,17H,5-10H2,1-2H3
InChIKeyNPHUEMMWCHSFRQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.90
Rot. Bonds3

About 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol

2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol (PubChem CID 117003508) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol.

Molecular Properties

Compound Name2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol
PubChem CID117003508
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol
SMILESCc1ccc(C)c(N2CCC(CCO)CC2)c1
InChIInChI=1S/C15H23NO/c1-12-3-4-13(2)15(11-12)16-8-5-14(6-9-16)7-10-17/h3-4,11,14,17H,5-10H2,1-2H3
InChIKeyNPHUEMMWCHSFRQ-UHFFFAOYSA-N
XLogP2.90
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[4-methyl-3-(trifluoromethyl)phenyl]piperidin-4-yl]ethanol
CID 71166795
3-[4-(2,5-dimethylphenyl)piperazin-1-yl]propan-1-ol
CID 15572518
2-[1-(4-methylphenyl)pyrrolidin-3-yl]ethanol
CID 117028445
2-[1-(2-propan-2-ylphenyl)piperidin-4-yl]ethanol
CID 117003516
4-methyl-2-(4-propylpiperidin-1-yl)benzoic acid
CID 62700990
1-(2,5-dimethylphenyl)-4-(hydroxymethyl)piperidin-4-ol
CID 143566862
2-[1-(4-methyl-2-nitrophenyl)pyrrolidin-3-yl]ethanol
CID 71865356
(3R)-1-(2,5-dimethylphenyl)-N,N-dimethylpyrrolidin-3-amine
CID 59886840
2-[1-(4-chloro-2-methylphenyl)pyrrolidin-3-yl]ethanol
CID 117028465
2-[1-(5,6-dimethylpyridazin-3-yl)piperidin-4-yl]ethanol
CID 21077795
[1-(2,5-dimethylphenyl)-4-(methylamino)piperidin-4-yl]methanol
CID 117012043
2-[3-(2-hydroxyethyl)piperidin-1-yl]-5-methylbenzaldehyde
CID 114054274

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol?
The IUPAC name of 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol (CID 117003508) is 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol.
What is the SMILES notation for 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol?
The canonical SMILES for 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol is Cc1ccc(C)c(N2CCC(CCO)CC2)c1.
What is the InChIKey of 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol?
The InChIKey is NPHUEMMWCHSFRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12-3-4-13(2)15(11-12)16-8-5-14(6-9-16)7-10-17/h3-4,11,14,17H,5-10H2,1-2H3.
What are the key properties of 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol?
2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol has a molecular weight of 233.36 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,5-dimethylphenyl)piperidin-4-yl]ethanol is sourced from PubChem (CID 117003508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).