4-phenylmethoxy-1-prop-2-enylpiperidine

C15H21NO — CID 57075697

IUPAC4-phenylmethoxy-1-prop-2-enylpiperidine
SMILESC=CCN1CCC(OCc2ccccc2)CC1
InChIInChI=1S/C15H21NO/c1-2-10-16-11-8-15(9-12-16)17-13-14-6-4-3-5-7-14/h2-7,15H,1,8-13H2
InChIKeyQRANVLTZZDWGGG-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.85
Rot. Bonds5

About 4-phenylmethoxy-1-prop-2-enylpiperidine

4-phenylmethoxy-1-prop-2-enylpiperidine (PubChem CID 57075697) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 4-phenylmethoxy-1-prop-2-enylpiperidine.

Molecular Properties

Compound Name4-phenylmethoxy-1-prop-2-enylpiperidine
PubChem CID57075697
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name4-phenylmethoxy-1-prop-2-enylpiperidine
SMILESC=CCN1CCC(OCc2ccccc2)CC1
InChIInChI=1S/C15H21NO/c1-2-10-16-11-8-15(9-12-16)17-13-14-6-4-3-5-7-14/h2-7,15H,1,8-13H2
InChIKeyQRANVLTZZDWGGG-UHFFFAOYSA-N
XLogP2.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-benzyl-4-phenylmethoxypiperidine
CID 15892976
1-benzyl-4-phenylmethoxypiperidine;hydrochloride
CID 18919828
2-(3-phenylmethoxypyrrolidin-1-yl)acetaldehyde
CID 131071412
(3R,4R,5R,6R)-3,4,5,6-tetrakis(phenylmethoxy)-1-prop-2-enylazepane
CID 71658430
N-methyl-4-phenylmethoxypiperidine-1-carboxamide
CID 131216132
2-[(4-phenylmethoxypiperidin-1-yl)methyl]isoindole-1,3-dione
CID 17416201
azane;cyclopentyloxymethylbenzene
CID 69411306
1-methyl-2-[(4-phenylmethoxypiperidin-1-yl)methyl]piperidine
CID 91843602
4-phenylmethoxypiperidine-1-sulfonic acid
CID 174878483
2-(4-phenylmethoxypiperidin-1-yl)pyrimidine
CID 95811444
4-phenylmethoxy-1-[[(3R)-piperidin-3-yl]methyl]piperidine
CID 95895392
4-phenylmethoxyoxane
CID 66554133

Frequently Asked Questions

What is the IUPAC name of 4-phenylmethoxy-1-prop-2-enylpiperidine?
The IUPAC name of 4-phenylmethoxy-1-prop-2-enylpiperidine (CID 57075697) is 4-phenylmethoxy-1-prop-2-enylpiperidine.
What is the SMILES notation for 4-phenylmethoxy-1-prop-2-enylpiperidine?
The canonical SMILES for 4-phenylmethoxy-1-prop-2-enylpiperidine is C=CCN1CCC(OCc2ccccc2)CC1.
What is the InChIKey of 4-phenylmethoxy-1-prop-2-enylpiperidine?
The InChIKey is QRANVLTZZDWGGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-10-16-11-8-15(9-12-16)17-13-14-6-4-3-5-7-14/h2-7,15H,1,8-13H2.
What are the key properties of 4-phenylmethoxy-1-prop-2-enylpiperidine?
4-phenylmethoxy-1-prop-2-enylpiperidine has a molecular weight of 231.34 g/mol, XLogP of 2.85, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmethoxy-1-prop-2-enylpiperidine is sourced from PubChem (CID 57075697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).