1-(3,3-diphenyl-3-propoxypropyl)piperidine

C23H31NO — CID 163484740

IUPAC1-(3,3-diphenyl-3-propoxypropyl)piperidine
SMILESCCCOC(CCN1CCCCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H31NO/c1-2-20-25-23(21-12-6-3-7-13-21,22-14-8-4-9-15-22)16-19-24-17-10-5-11-18-24/h3-4,6-9,12-15H,2,5,10-11,16-20H2,1H3
InChIKeyCHPUSEYIRKGTTJ-UHFFFAOYSA-N
MW337.51 g/mol
LogP5.23
Rot. Bonds8

About 1-(3,3-diphenyl-3-propoxypropyl)piperidine

1-(3,3-diphenyl-3-propoxypropyl)piperidine (PubChem CID 163484740) has the molecular formula C23H31NO and a molecular weight of 337.51 g/mol. Its IUPAC name is 1-(3,3-diphenyl-3-propoxypropyl)piperidine.

Molecular Properties

Compound Name1-(3,3-diphenyl-3-propoxypropyl)piperidine
PubChem CID163484740
Molecular FormulaC23H31NO
Molecular Weight337.51 g/mol
Exact Mass337.24
IUPAC Name1-(3,3-diphenyl-3-propoxypropyl)piperidine
SMILESCCCOC(CCN1CCCCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H31NO/c1-2-20-25-23(21-12-6-3-7-13-21,22-14-8-4-9-15-22)16-19-24-17-10-5-11-18-24/h3-4,6-9,12-15H,2,5,10-11,16-20H2,1H3
InChIKeyCHPUSEYIRKGTTJ-UHFFFAOYSA-N
XLogP5.23
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.51
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-2-phenyl-4-piperidin-1-ylbutanamide
CID 18110
2-(ethylamino)-2-phenyl-4-piperidin-1-ylbutanenitrile
CID 116692329
1-(2,3,4,5,6-pentadeuteriophenyl)-1-phenyl-3-piperidin-1-ylpropan-1-ol
CID 163322578
2-phenyl-2-(propylamino)-4-pyrrolidin-1-ylbutanoic acid
CID 116693516
2-(2-ethylphenyl)-2-phenyl-4-piperidin-1-ylbutanoic acid
CID 70474069
1-cyclohexyl-1-phenyl-3-piperidin-1-ylpropan-1-ol;iodomethane
CID 21127105
1-(azepan-1-yl)-2-phenylhexan-2-amine
CID 43829768
2-amino-4-(azocan-1-yl)-2-phenylbutanamide
CID 116693501
N-propoxy-N-(2-pyrrolidin-1-ylethyl)aniline
CID 87749970
2,2-diphenyl-5-piperidin-1-ylpentan-1-amine
CID 22767303
1-(3-diphenylphosphoryl-3,3-diphenylpropyl)piperidine;hydrochloride
CID 21117882
(1S)-1-cyclopentyl-1-phenyl-3-piperidin-1-ylpropan-1-ol;hydrochloride
CID 46878511

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-diphenyl-3-propoxypropyl)piperidine?
The IUPAC name of 1-(3,3-diphenyl-3-propoxypropyl)piperidine (CID 163484740) is 1-(3,3-diphenyl-3-propoxypropyl)piperidine.
What is the SMILES notation for 1-(3,3-diphenyl-3-propoxypropyl)piperidine?
The canonical SMILES for 1-(3,3-diphenyl-3-propoxypropyl)piperidine is CCCOC(CCN1CCCCC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-(3,3-diphenyl-3-propoxypropyl)piperidine?
The InChIKey is CHPUSEYIRKGTTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31NO/c1-2-20-25-23(21-12-6-3-7-13-21,22-14-8-4-9-15-22)16-19-24-17-10-5-11-18-24/h3-4,6-9,12-15H,2,5,10-11,16-20H2,1H3.
What are the key properties of 1-(3,3-diphenyl-3-propoxypropyl)piperidine?
1-(3,3-diphenyl-3-propoxypropyl)piperidine has a molecular weight of 337.51 g/mol, XLogP of 5.23, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-diphenyl-3-propoxypropyl)piperidine is sourced from PubChem (CID 163484740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).