(2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide

C18H25FN4O2 — CID 124728340

IUPAC(2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide
SMILESO=C(NCCN1CCNC1=O)[C@H](c1ccc(F)cc1)N1CCCCC1
InChIInChI=1S/C18H25FN4O2/c19-15-6-4-14(5-7-15)16(22-10-2-1-3-11-22)17(24)20-8-12-23-13-9-21-18(23)25/h4-7,16H,1-3,8-13H2,(H,20,24)(H,21,25)/t16-/m0/s1
InChIKeyKFPBAYNPCLFZNK-INIZCTEOSA-N
MW348.42 g/mol
LogP1.49
Rot. Bonds6

About (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide

(2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide (PubChem CID 124728340) has the molecular formula C18H25FN4O2 and a molecular weight of 348.42 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide
PubChem CID124728340
Molecular FormulaC18H25FN4O2
Molecular Weight348.42 g/mol
Exact Mass348.20
IUPAC Name(2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide
SMILESO=C(NCCN1CCNC1=O)[C@H](c1ccc(F)cc1)N1CCCCC1
InChIInChI=1S/C18H25FN4O2/c19-15-6-4-14(5-7-15)16(22-10-2-1-3-11-22)17(24)20-8-12-23-13-9-21-18(23)25/h4-7,16H,1-3,8-13H2,(H,20,24)(H,21,25)/t16-/m0/s1
InChIKeyKFPBAYNPCLFZNK-INIZCTEOSA-N
XLogP1.49
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-phenylpropanamide
CID 46996236
(2R)-2-(4-fluorophenyl)-2-piperidin-1-yl-N-(2-pyrazin-2-ylethyl)acetamide
CID 125166147
2-(4-fluorophenyl)-N-[[4-(hydroxymethyl)phenyl]methyl]-2-piperidin-1-ylacetamide
CID 131937524
2-(4-fluorophenyl)-2-piperidin-1-yl-N-(thiophen-3-ylmethyl)acetamide
CID 131924426
N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-2-(4-fluorophenyl)-2-piperidin-1-ylacetamide
CID 91832556
2-(4-fluorophenyl)-2-pyrrolidin-1-ylacetamide
CID 82114619
N-[2-(2-oxoimidazolidin-1-yl)ethyl]propanamide
CID 59804618
N-[2-(2-oxoimidazolidin-1-yl)ethyl]carbamate
CID 18454819
(3Z)-1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoylimino]urea
CID 88552348
N-[2-(2-oxoimidazolidin-1-yl)ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide
CID 118795910
2-(1,4-diazepan-1-yl)-2-(4-fluorophenyl)acetic acid
CID 54890531
1-[2-(2,5-difluoroanilino)ethyl]imidazolidin-2-one
CID 28574585

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide?
The IUPAC name of (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide (CID 124728340) is (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide.
What is the SMILES notation for (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide?
The canonical SMILES for (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide is O=C(NCCN1CCNC1=O)[C@H](c1ccc(F)cc1)N1CCCCC1.
What is the InChIKey of (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide?
The InChIKey is KFPBAYNPCLFZNK-INIZCTEOSA-N. The full InChI is InChI=1S/C18H25FN4O2/c19-15-6-4-14(5-7-15)16(22-10-2-1-3-11-22)17(24)20-8-12-23-13-9-21-18(23)25/h4-7,16H,1-3,8-13H2,(H,20,24)(H,21,25)/t16-/m0/s1.
What are the key properties of (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide?
(2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide has a molecular weight of 348.42 g/mol, XLogP of 1.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenyl)-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-2-piperidin-1-ylacetamide is sourced from PubChem (CID 124728340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).