4-(2-propan-2-ylpiperidin-2-yl)phenol

C14H21NO — CID 115058712

IUPAC4-(2-propan-2-ylpiperidin-2-yl)phenol
SMILESCC(C)C1(c2ccc(O)cc2)CCCCN1
InChIInChI=1S/C14H21NO/c1-11(2)14(9-3-4-10-15-14)12-5-7-13(16)8-6-12/h5-8,11,15-16H,3-4,9-10H2,1-2H3
InChIKeyHRIZPSKUZQAICG-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.02
Rot. Bonds2

About 4-(2-propan-2-ylpiperidin-2-yl)phenol

4-(2-propan-2-ylpiperidin-2-yl)phenol (PubChem CID 115058712) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-(2-propan-2-ylpiperidin-2-yl)phenol.

Molecular Properties

Compound Name4-(2-propan-2-ylpiperidin-2-yl)phenol
PubChem CID115058712
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-(2-propan-2-ylpiperidin-2-yl)phenol
SMILESCC(C)C1(c2ccc(O)cc2)CCCCN1
InChIInChI=1S/C14H21NO/c1-11(2)14(9-3-4-10-15-14)12-5-7-13(16)8-6-12/h5-8,11,15-16H,3-4,9-10H2,1-2H3
InChIKeyHRIZPSKUZQAICG-UHFFFAOYSA-N
XLogP3.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-propan-2-ylpyrrolidin-2-yl)phenol
CID 115058626
2-propan-2-yl-2-(4-propan-2-ylphenyl)azepane
CID 79116630
4-(2-methylazepan-2-yl)phenol
CID 115059442
2-(3,4-dimethylphenyl)-2-propan-2-ylpyrrolidine
CID 66465151
2-(3-chlorophenyl)-2-propan-2-ylpiperidine
CID 115058678
2-(3-bromophenyl)-2-propan-2-ylazepane
CID 115059411
2-(3,4-dimethoxyphenyl)-2-propan-2-ylpyrrolidine
CID 66467199
N,N-dimethyl-5-(2-propan-2-ylpyrrolidin-2-yl)pyridin-2-amine
CID 114273153
2-(2,6-difluorophenyl)-2-propan-2-ylazepane
CID 79118040
2-(3-cyclobutylphenyl)-2-propan-2-ylazepane
CID 114603856
4-(2-methylpyrrolidin-2-yl)phenol
CID 82599572
2-(2,4-difluorophenyl)-2-propan-2-ylazepane
CID 79116821

Frequently Asked Questions

What is the IUPAC name of 4-(2-propan-2-ylpiperidin-2-yl)phenol?
The IUPAC name of 4-(2-propan-2-ylpiperidin-2-yl)phenol (CID 115058712) is 4-(2-propan-2-ylpiperidin-2-yl)phenol.
What is the SMILES notation for 4-(2-propan-2-ylpiperidin-2-yl)phenol?
The canonical SMILES for 4-(2-propan-2-ylpiperidin-2-yl)phenol is CC(C)C1(c2ccc(O)cc2)CCCCN1.
What is the InChIKey of 4-(2-propan-2-ylpiperidin-2-yl)phenol?
The InChIKey is HRIZPSKUZQAICG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11(2)14(9-3-4-10-15-14)12-5-7-13(16)8-6-12/h5-8,11,15-16H,3-4,9-10H2,1-2H3.
What are the key properties of 4-(2-propan-2-ylpiperidin-2-yl)phenol?
4-(2-propan-2-ylpiperidin-2-yl)phenol has a molecular weight of 219.33 g/mol, XLogP of 3.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-propan-2-ylpiperidin-2-yl)phenol is sourced from PubChem (CID 115058712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).