3-phenyl-1-propan-2-ylpiperidin-3-ol

C14H21NO — CID 12689966

IUPAC3-phenyl-1-propan-2-ylpiperidin-3-ol
SMILESCC(C)N1CCCC(O)(c2ccccc2)C1
InChIInChI=1S/C14H21NO/c1-12(2)15-10-6-9-14(16,11-15)13-7-4-3-5-8-13/h3-5,7-8,12,16H,6,9-11H2,1-2H3
InChIKeyOQYQXKMXDKTIMC-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.38
Rot. Bonds2

About 3-phenyl-1-propan-2-ylpiperidin-3-ol

3-phenyl-1-propan-2-ylpiperidin-3-ol (PubChem CID 12689966) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-phenyl-1-propan-2-ylpiperidin-3-ol.

Molecular Properties

Compound Name3-phenyl-1-propan-2-ylpiperidin-3-ol
PubChem CID12689966
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name3-phenyl-1-propan-2-ylpiperidin-3-ol
SMILESCC(C)N1CCCC(O)(c2ccccc2)C1
InChIInChI=1S/C14H21NO/c1-12(2)15-10-6-9-14(16,11-15)13-7-4-3-5-8-13/h3-5,7-8,12,16H,6,9-11H2,1-2H3
InChIKeyOQYQXKMXDKTIMC-UHFFFAOYSA-N
XLogP2.38
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenyl-1-propan-2-ylazetidin-3-ol
CID 58547253
3-phenyl-1-(1-phenylpropyl)piperidin-3-ol
CID 18621526
4-(4-fluorophenyl)-1-propan-2-ylazepan-4-ol
CID 65077824
1-[(1S,2S)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]-3-phenylpyrrolidin-3-ol
CID 70057699
3-methyl-1-propan-2-ylpiperidin-3-ol
CID 69087871
ethane;1-phenylcyclohexan-1-ol
CID 144640846
3-(3-methylphenyl)-1-propan-2-ylazetidin-3-ol
CID 176766940
azane;1-phenylcyclobutan-1-ol
CID 175547532
4-[3-(2-methylpropyl)phenyl]-1-propan-2-ylazepan-4-ol
CID 116542614
4-(furan-2-yl)-1-propan-2-ylazepan-4-ol
CID 65077325
1-propan-2-yl-4-thiophen-3-ylazepan-4-ol
CID 65099457
copper;1-phenylcyclohexan-1-ol
CID 174727157

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1-propan-2-ylpiperidin-3-ol?
The IUPAC name of 3-phenyl-1-propan-2-ylpiperidin-3-ol (CID 12689966) is 3-phenyl-1-propan-2-ylpiperidin-3-ol.
What is the SMILES notation for 3-phenyl-1-propan-2-ylpiperidin-3-ol?
The canonical SMILES for 3-phenyl-1-propan-2-ylpiperidin-3-ol is CC(C)N1CCCC(O)(c2ccccc2)C1.
What is the InChIKey of 3-phenyl-1-propan-2-ylpiperidin-3-ol?
The InChIKey is OQYQXKMXDKTIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-12(2)15-10-6-9-14(16,11-15)13-7-4-3-5-8-13/h3-5,7-8,12,16H,6,9-11H2,1-2H3.
What are the key properties of 3-phenyl-1-propan-2-ylpiperidin-3-ol?
3-phenyl-1-propan-2-ylpiperidin-3-ol has a molecular weight of 219.33 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1-propan-2-ylpiperidin-3-ol is sourced from PubChem (CID 12689966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).