4-(cyclopropyloxymethyl)-1-phenylpiperidine

C15H21NO — CID 10443904

IUPAC4-(cyclopropyloxymethyl)-1-phenylpiperidine
SMILESc1ccc(N2CCC(COC3CC3)CC2)cc1
InChIInChI=1S/C15H21NO/c1-2-4-14(5-3-1)16-10-8-13(9-11-16)12-17-15-6-7-15/h1-5,13,15H,6-12H2
InChIKeyUPDMVHLBOSCWDM-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.08
Rot. Bonds4

About 4-(cyclopropyloxymethyl)-1-phenylpiperidine

4-(cyclopropyloxymethyl)-1-phenylpiperidine (PubChem CID 10443904) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 4-(cyclopropyloxymethyl)-1-phenylpiperidine.

Molecular Properties

Compound Name4-(cyclopropyloxymethyl)-1-phenylpiperidine
PubChem CID10443904
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name4-(cyclopropyloxymethyl)-1-phenylpiperidine
SMILESc1ccc(N2CCC(COC3CC3)CC2)cc1
InChIInChI=1S/C15H21NO/c1-2-4-14(5-3-1)16-10-8-13(9-11-16)12-17-15-6-7-15/h1-5,13,15H,6-12H2
InChIKeyUPDMVHLBOSCWDM-UHFFFAOYSA-N
XLogP3.08
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-phenylpiperidin-4-yl)oxypropanoic acid
CID 174770729
(2S,3R,4R,5S)-2-(hydroxymethyl)-1-[(1-phenylpiperidin-4-yl)methyl]piperidine-3,4,5-triol
CID 157039541
[(3S)-1-phenylpyrrolidin-3-yl]methanol
CID 42258987
ethane;4-[(3-ethylazetidin-1-yl)methyl]-1-phenylpiperidine
CID 171069599
N-[3-(cyclopropylmethoxy)propyl]-1-phenylpiperidin-4-amine
CID 103776355
1-phenylpiperidin-4-ol;dihydrochloride
CID 174840165
ethane;4-methyl-1-phenylpiperidine
CID 143180672
1-phenyl-N-phenylmethoxypiperidin-4-amine
CID 106820391
3-ethoxy-3-[4-[(1-phenylpiperidin-4-yl)methoxy]phenyl]propanoic acid
CID 67058139
4-[4-(phenoxymethoxy)piperidin-1-yl]pyridine
CID 139888381
1-(4-isocyanophenyl)-4-phenylmethoxypiperidine
CID 140728394
ethane;1-[(1-phenylpiperidin-4-yl)methyl]-4-(piperidin-4-ylmethyl)piperazine;propane
CID 171069899

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropyloxymethyl)-1-phenylpiperidine?
The IUPAC name of 4-(cyclopropyloxymethyl)-1-phenylpiperidine (CID 10443904) is 4-(cyclopropyloxymethyl)-1-phenylpiperidine.
What is the SMILES notation for 4-(cyclopropyloxymethyl)-1-phenylpiperidine?
The canonical SMILES for 4-(cyclopropyloxymethyl)-1-phenylpiperidine is c1ccc(N2CCC(COC3CC3)CC2)cc1.
What is the InChIKey of 4-(cyclopropyloxymethyl)-1-phenylpiperidine?
The InChIKey is UPDMVHLBOSCWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-4-14(5-3-1)16-10-8-13(9-11-16)12-17-15-6-7-15/h1-5,13,15H,6-12H2.
What are the key properties of 4-(cyclopropyloxymethyl)-1-phenylpiperidine?
4-(cyclopropyloxymethyl)-1-phenylpiperidine has a molecular weight of 231.34 g/mol, XLogP of 3.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropyloxymethyl)-1-phenylpiperidine is sourced from PubChem (CID 10443904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).