4-(azetidin-1-yl)-1-phenylpiperidine

C14H20N2 — CID 174605037

IUPAC4-(azetidin-1-yl)-1-phenylpiperidine
SMILESc1ccc(N2CCC(N3CCC3)CC2)cc1
InChIInChI=1S/C14H20N2/c1-2-5-13(6-3-1)16-11-7-14(8-12-16)15-9-4-10-15/h1-3,5-6,14H,4,7-12H2
InChIKeyJSDHMKVLBACHRY-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.36
Rot. Bonds2

About 4-(azetidin-1-yl)-1-phenylpiperidine

4-(azetidin-1-yl)-1-phenylpiperidine (PubChem CID 174605037) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 4-(azetidin-1-yl)-1-phenylpiperidine.

Molecular Properties

Compound Name4-(azetidin-1-yl)-1-phenylpiperidine
PubChem CID174605037
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name4-(azetidin-1-yl)-1-phenylpiperidine
SMILESc1ccc(N2CCC(N3CCC3)CC2)cc1
InChIInChI=1S/C14H20N2/c1-2-5-13(6-3-1)16-11-7-14(8-12-16)15-9-4-10-15/h1-3,5-6,14H,4,7-12H2
InChIKeyJSDHMKVLBACHRY-UHFFFAOYSA-N
XLogP2.36
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-phenylpiperidin-4-yl)piperazine
CID 2737157
1-cycloheptyl-4-phenylpiperazine
CID 2846720
1-phenyl-4-(3-piperidin-1-ylcyclobutyl)oxypiperidine
CID 171069376
1-phenyl-4-[1-(4-phenylcyclohexyl)piperidin-4-yl]piperazine
CID 1317152
(4-phenylpiperazin-1-yl)-[2-(4-piperidin-1-ylpiperidin-1-yl)phenyl]methanone
CID 23130829
1-phenyl-4-[1-[(3S)-thiolan-3-yl]piperidin-4-yl]piperazine
CID 124841342
1-[4-[(3R)-3-(4-phenylpiperazin-1-yl)piperidin-1-yl]piperidin-1-yl]ethanone
CID 28957439
(4aS,7aS)-6-(1-phenylpiperidin-4-yl)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 106820720
2-[1-(1-phenylpiperidin-4-yl)azetidin-3-yl]acetic acid
CID 106821074
1-(4-ethylphenyl)-4-piperidin-1-ylpiperidine
CID 59545859
(7aS)-2-phenyl-1,3,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazole
CID 141032267
[(3S)-3-(2-methoxyethyl)-1-(1-phenylpiperidin-4-yl)piperidin-3-yl]methanol
CID 97130641

Frequently Asked Questions

What is the IUPAC name of 4-(azetidin-1-yl)-1-phenylpiperidine?
The IUPAC name of 4-(azetidin-1-yl)-1-phenylpiperidine (CID 174605037) is 4-(azetidin-1-yl)-1-phenylpiperidine.
What is the SMILES notation for 4-(azetidin-1-yl)-1-phenylpiperidine?
The canonical SMILES for 4-(azetidin-1-yl)-1-phenylpiperidine is c1ccc(N2CCC(N3CCC3)CC2)cc1.
What is the InChIKey of 4-(azetidin-1-yl)-1-phenylpiperidine?
The InChIKey is JSDHMKVLBACHRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-2-5-13(6-3-1)16-11-7-14(8-12-16)15-9-4-10-15/h1-3,5-6,14H,4,7-12H2.
What are the key properties of 4-(azetidin-1-yl)-1-phenylpiperidine?
4-(azetidin-1-yl)-1-phenylpiperidine has a molecular weight of 216.33 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidin-1-yl)-1-phenylpiperidine is sourced from PubChem (CID 174605037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).