3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol

C17H27NO — CID 21153822

IUPAC3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol
SMILESOCCCN1CCCCC1CCCc1ccccc1
InChIInChI=1S/C17H27NO/c19-15-7-14-18-13-5-4-11-17(18)12-6-10-16-8-2-1-3-9-16/h1-3,8-9,17,19H,4-7,10-15H2
InChIKeyLTXFTSDZPOORQZ-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.25
Rot. Bonds7

About 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol

3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol (PubChem CID 21153822) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol
PubChem CID21153822
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol
SMILESOCCCN1CCCCC1CCCc1ccccc1
InChIInChI=1S/C17H27NO/c19-15-7-14-18-13-5-4-11-17(18)12-6-10-16-8-2-1-3-9-16/h1-3,8-9,17,19H,4-7,10-15H2
InChIKeyLTXFTSDZPOORQZ-UHFFFAOYSA-N
XLogP3.25
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(2R)-1-(2-phenylethyl)piperidin-2-yl]methanol
CID 26457952
3-[1-(3-phenylpropyl)pyrrolidin-2-yl]propanoic acid
CID 82183365
2-(2-chloroethyl)-1-(2-phenylethyl)piperidine
CID 63387052
1-methyl-2-(3-phenylpropyl)pyrrolidine
CID 15758084
[1-(2-phenylethyl)pyrrolidin-2-yl]methanol
CID 13404761
methyl 2-[1-(3-phenylpropyl)piperidin-2-yl]acetate
CID 61034555
6-[2-(2-hydroxyethyl)piperidin-1-yl]hexan-1-ol
CID 103737919
1-[1-(2-phenylethyl)azepan-2-yl]propan-2-ol
CID 114338750
2-[1-[2-(4-aminophenyl)ethyl]piperidin-2-yl]ethanol
CID 43519577
(2S)-1-(2-methylsulfonylethyl)-2-(2-phenylethyl)piperidine
CID 97101388
3-[2-(hydroxymethyl)piperidin-1-yl]propan-1-ol;hydrobromide
CID 21144774
3-[(2R)-1-benzylpiperidin-2-yl]propane-1-thiol
CID 97169944

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol?
The IUPAC name of 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol (CID 21153822) is 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol.
What is the SMILES notation for 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol?
The canonical SMILES for 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol is OCCCN1CCCCC1CCCc1ccccc1.
What is the InChIKey of 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol?
The InChIKey is LTXFTSDZPOORQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c19-15-7-14-18-13-5-4-11-17(18)12-6-10-16-8-2-1-3-9-16/h1-3,8-9,17,19H,4-7,10-15H2.
What are the key properties of 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol?
3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol has a molecular weight of 261.41 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-phenylpropyl)piperidin-1-yl]propan-1-ol is sourced from PubChem (CID 21153822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).