1-(1-phenoxy-3-phenylpropyl)piperidine

C20H25NO — CID 57051930

IUPAC1-(1-phenoxy-3-phenylpropyl)piperidine
SMILESc1ccc(CCC(Oc2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/C20H25NO/c1-4-10-18(11-5-1)14-15-20(21-16-8-3-9-17-21)22-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyZDSLHKYSXAVALC-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.51
Rot. Bonds6

About 1-(1-phenoxy-3-phenylpropyl)piperidine

1-(1-phenoxy-3-phenylpropyl)piperidine (PubChem CID 57051930) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is 1-(1-phenoxy-3-phenylpropyl)piperidine.

Molecular Properties

Compound Name1-(1-phenoxy-3-phenylpropyl)piperidine
PubChem CID57051930
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name1-(1-phenoxy-3-phenylpropyl)piperidine
SMILESc1ccc(CCC(Oc2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/C20H25NO/c1-4-10-18(11-5-1)14-15-20(21-16-8-3-9-17-21)22-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyZDSLHKYSXAVALC-UHFFFAOYSA-N
XLogP4.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-1-piperidin-1-ylbutan-1-amine;dihydrochloride
CID 67607516
1-[(1S)-1-(2-hydroxyphenoxy)-3-(4-phenoxyphenyl)propyl]piperidin-4-ol
CID 68827727
4-(3-phenyl-1-piperidin-1-ylpropyl)cyclohexan-1-one
CID 66756268
1-[phenylmethoxy(piperidin-1-yl)methyl]piperidine
CID 3477128
1-(1,5-diphenylpent-1-yn-3-yl)pyrrolidine
CID 142730750
1-(azocan-1-yl)-4-phenylbutan-2-amine
CID 114929504
4-phenyl-1-piperidin-1-ylbutan-2-ol
CID 57323966
1-[1-(1,4-dioxaspiro[4.5]decan-8-yl)-3-phenylpropyl]piperidine
CID 66756108
4-[2-[2-(2-phenylethyl)phenoxy]ethoxy]-4-pyrrolidin-1-ylbutanoic acid
CID 3030923
1-methoxy-4-[(3S)-5-phenylpent-1-yn-3-yl]oxybenzene
CID 134967057
1-(1-phenylpropan-2-yl)piperidine
CID 11321650
4-phenyl-1-pyrrolidin-1-ylbutan-2-amine
CID 114929475

Frequently Asked Questions

What is the IUPAC name of 1-(1-phenoxy-3-phenylpropyl)piperidine?
The IUPAC name of 1-(1-phenoxy-3-phenylpropyl)piperidine (CID 57051930) is 1-(1-phenoxy-3-phenylpropyl)piperidine.
What is the SMILES notation for 1-(1-phenoxy-3-phenylpropyl)piperidine?
The canonical SMILES for 1-(1-phenoxy-3-phenylpropyl)piperidine is c1ccc(CCC(Oc2ccccc2)N2CCCCC2)cc1.
What is the InChIKey of 1-(1-phenoxy-3-phenylpropyl)piperidine?
The InChIKey is ZDSLHKYSXAVALC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-4-10-18(11-5-1)14-15-20(21-16-8-3-9-17-21)22-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2.
What are the key properties of 1-(1-phenoxy-3-phenylpropyl)piperidine?
1-(1-phenoxy-3-phenylpropyl)piperidine has a molecular weight of 295.43 g/mol, XLogP of 4.51, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenoxy-3-phenylpropyl)piperidine is sourced from PubChem (CID 57051930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).