1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one

C16H22FN3O2 — CID 94392496

IUPAC1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(C[C@H](O)c2ccc(F)cc2)CC1
InChIInChI=1S/C16H22FN3O2/c17-13-3-1-12(2-4-13)15(21)11-19-8-5-14(6-9-19)20-10-7-18-16(20)22/h1-4,14-15,21H,5-11H2,(H,18,22)/t15-/m0/s1
InChIKeyVHOTZHMJMWACJU-HNNXBMFYSA-N
MW307.37 g/mol
LogP1.35
Rot. Bonds4

About 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one

1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 94392496) has the molecular formula C16H22FN3O2 and a molecular weight of 307.37 g/mol. Its IUPAC name is 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one
PubChem CID94392496
Molecular FormulaC16H22FN3O2
Molecular Weight307.37 g/mol
Exact Mass307.17
IUPAC Name1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(C[C@H](O)c2ccc(F)cc2)CC1
InChIInChI=1S/C16H22FN3O2/c17-13-3-1-12(2-4-13)15(21)11-19-8-5-14(6-9-19)20-10-7-18-16(20)22/h1-4,14-15,21H,5-11H2,(H,18,22)/t15-/m0/s1
InChIKeyVHOTZHMJMWACJU-HNNXBMFYSA-N
XLogP1.35
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[(2S)-3-(4-fluorophenoxy)-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one
CID 94392487
1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one
CID 68820432
1-(4-fluorophenyl)-2-(4-methoxypiperidin-1-yl)ethanol
CID 110883521
1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-N-methylpiperidine-4-carboxamide
CID 32657544
(2S)-2-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]-2-hydroxyacetamide
CID 129489869
2-[4-(2,2-difluoroethyl)piperazin-1-yl]-1-(4-fluorophenyl)ethanol
CID 110910508
1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one
CID 18340088
1-(4-fluorophenyl)-2-morpholin-4-ylethanol
CID 3678809
1-[1-[(2R)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxypropyl]piperidin-4-yl]imidazolidin-2-one
CID 95582475
1-[1-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-4-yl]imidazolidin-2-one
CID 56815838
1-[1-[(2S)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]piperidin-4-yl]imidazolidin-2-one
CID 95329642
3-[1-[(2R)-2-(4-chlorophenyl)-2-hydroxyethyl]piperidin-4-yl]-1,4-dihydroquinazolin-2-one
CID 92968130

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one (CID 94392496) is 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one is O=C1NCCN1C1CCN(C[C@H](O)c2ccc(F)cc2)CC1.
What is the InChIKey of 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is VHOTZHMJMWACJU-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H22FN3O2/c17-13-3-1-12(2-4-13)15(21)11-19-8-5-14(6-9-19)20-10-7-18-16(20)22/h1-4,14-15,21H,5-11H2,(H,18,22)/t15-/m0/s1.
What are the key properties of 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 307.37 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 94392496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).