[4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone

C14H19NO2 — CID 20613864

IUPAC[4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone
SMILESO=C(c1ccc(CCO)cc1)C1CCNCC1
InChIInChI=1S/C14H19NO2/c16-10-7-11-1-3-12(4-2-11)14(17)13-5-8-15-9-6-13/h1-4,13,15-16H,5-10H2
InChIKeyVHPZLBVTJXWOKR-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.40
Rot. Bonds4

About [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone

[4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone (PubChem CID 20613864) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone.

Molecular Properties

Compound Name[4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone
PubChem CID20613864
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name[4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone
SMILESO=C(c1ccc(CCO)cc1)C1CCNCC1
InChIInChI=1S/C14H19NO2/c16-10-7-11-1-3-12(4-2-11)14(17)13-5-8-15-9-6-13/h1-4,13,15-16H,5-10H2
InChIKeyVHPZLBVTJXWOKR-UHFFFAOYSA-N
XLogP1.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3-methylbutyl)phenyl]-piperidin-4-ylmethanone;hydrochloride
CID 162315237
(4-hydroxyphenyl)-piperidin-4-ylmethanone;hydrochloride
CID 13180305
[4-[[di(propan-2-yl)amino]methyl]phenyl]-piperidin-4-ylmethanone
CID 22628177
[2-[3-(hydroxymethyl)phenyl]pyrimidin-5-yl]-piperidin-4-ylmethanone
CID 175605734
piperidin-4-yl-(4-propylsulfanylphenyl)methanone
CID 82553748
phenyl-[(3R)-pyrrolidin-3-yl]methanone
CID 86327261
azetidin-3-yl-(4-propylphenyl)methanone
CID 116583611
cyclopropyl-[4-(4-propylphenyl)phenyl]methanone
CID 145118080
4-[2-(piperidine-4-carbonylamino)ethyl]benzoic acid
CID 61161224
piperidin-4-yl-(4-trimethylsilyloxyphenyl)methanone
CID 167722571
piperidin-4-yl-[4-(trifluoromethoxy)phenyl]methanone
CID 23081458
(4-propan-2-ylphenyl)-pyrrolidin-3-ylmethanone
CID 83689928

Frequently Asked Questions

What is the IUPAC name of [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone?
The IUPAC name of [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone (CID 20613864) is [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone.
What is the SMILES notation for [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone?
The canonical SMILES for [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone is O=C(c1ccc(CCO)cc1)C1CCNCC1.
What is the InChIKey of [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone?
The InChIKey is VHPZLBVTJXWOKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c16-10-7-11-1-3-12(4-2-11)14(17)13-5-8-15-9-6-13/h1-4,13,15-16H,5-10H2.
What are the key properties of [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone?
[4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone has a molecular weight of 233.31 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-hydroxyethyl)phenyl]-piperidin-4-ylmethanone is sourced from PubChem (CID 20613864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).