1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol

C13H19NO — CID 154574830

IUPAC1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol
SMILESCC(O)c1ccc([C@@H]2CCCNC2)cc1
InChIInChI=1S/C13H19NO/c1-10(15)11-4-6-12(7-5-11)13-3-2-8-14-9-13/h4-7,10,13-15H,2-3,8-9H2,1H3/t10?,13-/m1/s1
InChIKeySICFBBWCTCWIKC-JLOHTSLTSA-N
MW205.30 g/mol
LogP2.21
Rot. Bonds2

About 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol

1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol (PubChem CID 154574830) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol.

Molecular Properties

Compound Name1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol
PubChem CID154574830
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol
SMILESCC(O)c1ccc([C@@H]2CCCNC2)cc1
InChIInChI=1S/C13H19NO/c1-10(15)11-4-6-12(7-5-11)13-3-2-8-14-9-13/h4-7,10,13-15H,2-3,8-9H2,1H3/t10?,13-/m1/s1
InChIKeySICFBBWCTCWIKC-JLOHTSLTSA-N
XLogP2.21
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-propan-2-ylphenyl)piperidine
CID 58015975
3-[4-(1-methoxyethyl)phenyl]piperidine
CID 117313118
3-(4-tert-butylphenyl)piperidine
CID 24904200
1-(4-piperidin-3-ylphenyl)ethanone
CID 83404173
3-[4-(2-fluoropropyl)phenyl]piperidine
CID 84687072
3-(4-methoxyphenyl)piperidine
CID 12937920
3-(4-butan-2-ylphenyl)pyrrolidine
CID 82112617
3-(4-ethylsulfanylphenyl)piperidine
CID 82494383
3-[4-(thietan-3-yl)phenyl]piperidine
CID 115006012
(3S)-3-[4-(trifluoromethyl)phenyl]piperidine;hydrochloride
CID 45074262
(3R)-3-[4-(trifluoromethyl)phenyl]piperidine;hydrochloride
CID 45074264
2-amino-1-(4-pyrrolidin-3-ylphenyl)ethanol
CID 116988484

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol?
The IUPAC name of 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol (CID 154574830) is 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol.
What is the SMILES notation for 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol?
The canonical SMILES for 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol is CC(O)c1ccc([C@@H]2CCCNC2)cc1.
What is the InChIKey of 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol?
The InChIKey is SICFBBWCTCWIKC-JLOHTSLTSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(15)11-4-6-12(7-5-11)13-3-2-8-14-9-13/h4-7,10,13-15H,2-3,8-9H2,1H3/t10?,13-/m1/s1.
What are the key properties of 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol?
1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol has a molecular weight of 205.30 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol is sourced from PubChem (CID 154574830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).