3-[3-(2-methylpiperidin-1-yl)propyl]phenol

C15H23NO — CID 82187955

IUPAC3-[3-(2-methylpiperidin-1-yl)propyl]phenol
SMILESCC1CCCCN1CCCc1cccc(O)c1
InChIInChI=1S/C15H23NO/c1-13-6-2-3-10-16(13)11-5-8-14-7-4-9-15(17)12-14/h4,7,9,12-13,17H,2-3,5-6,8,10-11H2,1H3
InChIKeyHROQCZUEUMXFTN-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.20
Rot. Bonds4

About 3-[3-(2-methylpiperidin-1-yl)propyl]phenol

3-[3-(2-methylpiperidin-1-yl)propyl]phenol (PubChem CID 82187955) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 3-[3-(2-methylpiperidin-1-yl)propyl]phenol.

Molecular Properties

Compound Name3-[3-(2-methylpiperidin-1-yl)propyl]phenol
PubChem CID82187955
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name3-[3-(2-methylpiperidin-1-yl)propyl]phenol
SMILESCC1CCCCN1CCCc1cccc(O)c1
InChIInChI=1S/C15H23NO/c1-13-6-2-3-10-16(13)11-5-8-14-7-4-9-15(17)12-14/h4,7,9,12-13,17H,2-3,5-6,8,10-11H2,1H3
InChIKeyHROQCZUEUMXFTN-UHFFFAOYSA-N
XLogP3.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-(2-methylpiperidin-1-yl)butyl]phenol
CID 82187998
1-cyclopentyl-3-(3-hydroxyphenyl)-2-[3-(2-methylpiperidin-1-yl)propyl]guanidine
CID 134092019
4-[3-(2-methylpyrrolidin-1-yl)propyl]aniline
CID 115341800
1-[2-(3-methoxyphenyl)ethyl]-2-methyl-3-[3-(2-methylpiperidin-1-yl)propyl]guanidine
CID 111371129
3-[2-(1-methylpyrrolidin-2-yl)ethyl]phenol
CID 84673587
3-[7-methyl-1-(2-phenylethyl)azepan-3-yl]phenol;prop-1-ene
CID 170752367
3-(2-methylpiperidin-1-yl)propyl 3-phenylpropanoate;hydrochloride
CID 3051498
3-[12-(3-hydroxyphenyl)dodecyl]phenol
CID 169297924
2-methyl-1-[(3-propylphenyl)methyl]pyrrolidine
CID 171523670
1-(2,6-dimethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
CID 61399740
3-[(2R)-2-methylpiperidin-1-yl]-N-[[4-[[3-[(2R)-2-methylpiperidin-1-yl]propylamino]methyl]phenyl]methyl]propan-1-amine
CID 71451639
3-[(2S)-2-methylpiperidin-1-yl]-N-[[4-[[3-[(2S)-2-methylpiperidin-1-yl]propylamino]methyl]phenyl]methyl]propan-1-amine
CID 71455186

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methylpiperidin-1-yl)propyl]phenol?
The IUPAC name of 3-[3-(2-methylpiperidin-1-yl)propyl]phenol (CID 82187955) is 3-[3-(2-methylpiperidin-1-yl)propyl]phenol.
What is the SMILES notation for 3-[3-(2-methylpiperidin-1-yl)propyl]phenol?
The canonical SMILES for 3-[3-(2-methylpiperidin-1-yl)propyl]phenol is CC1CCCCN1CCCc1cccc(O)c1.
What is the InChIKey of 3-[3-(2-methylpiperidin-1-yl)propyl]phenol?
The InChIKey is HROQCZUEUMXFTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-13-6-2-3-10-16(13)11-5-8-14-7-4-9-15(17)12-14/h4,7,9,12-13,17H,2-3,5-6,8,10-11H2,1H3.
What are the key properties of 3-[3-(2-methylpiperidin-1-yl)propyl]phenol?
3-[3-(2-methylpiperidin-1-yl)propyl]phenol has a molecular weight of 233.35 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methylpiperidin-1-yl)propyl]phenol is sourced from PubChem (CID 82187955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).