1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one

C17H30N4O2 — CID 94424214

IUPAC1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one
SMILESCC[C@H]1CCCCN1C(=O)CN1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C17H30N4O2/c1-2-14-5-3-4-9-20(14)16(22)13-19-10-6-15(7-11-19)21-12-8-18-17(21)23/h14-15H,2-13H2,1H3,(H,18,23)/t14-/m0/s1
InChIKeyBHAOJIAVKLHNFA-AWEZNQCLSA-N
MW322.45 g/mol
LogP1.27
Rot. Bonds4

About 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one

1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 94424214) has the molecular formula C17H30N4O2 and a molecular weight of 322.45 g/mol. Its IUPAC name is 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one
PubChem CID94424214
Molecular FormulaC17H30N4O2
Molecular Weight322.45 g/mol
Exact Mass322.24
IUPAC Name1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one
SMILESCC[C@H]1CCCCN1C(=O)CN1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C17H30N4O2/c1-2-14-5-3-4-9-20(14)16(22)13-19-10-6-15(7-11-19)21-12-8-18-17(21)23/h14-15H,2-13H2,1H3,(H,18,23)/t14-/m0/s1
InChIKeyBHAOJIAVKLHNFA-AWEZNQCLSA-N
XLogP1.27
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one with MolForge

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Related Compounds

1-(2-ethylpiperidin-1-yl)-2-[4-(1-hydroxyethyl)piperidin-1-yl]ethanone
CID 103657075
2-(4-acetylpiperazin-1-yl)-1-(2-ethylpiperidin-1-yl)ethanone
CID 108996084
2-(3,5-dimethylpiperazin-1-yl)-1-(2-ethylpiperidin-1-yl)ethanone
CID 63872741
2-[(3S)-3-aminopyrrolidin-1-yl]-1-(2-ethylpiperidin-1-yl)ethanone;hydrochloride
CID 119933610
2-[4-(cyclopropylmethylamino)piperidin-1-yl]-1-(2-ethylpiperidin-1-yl)ethanone
CID 119926286
1-(2-ethylpiperidin-1-yl)-2-(4-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 114681192
1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 40538705
1-(2-ethylpiperidin-1-yl)-2-(3-hydroxypiperidin-1-yl)ethanone
CID 55028926
1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]pyrrolidin-2-one
CID 39954212
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1-(2-ethylpiperidin-1-yl)ethanone
CID 109003227
2-[3-(aminomethyl)pyrrolidin-1-yl]-1-(2-ethylpiperidin-1-yl)ethanone;hydrochloride
CID 119917745
1-(2-ethylpiperidin-1-yl)-2-methylsulfanylethanone
CID 42891834

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one (CID 94424214) is 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one is CC[C@H]1CCCCN1C(=O)CN1CCC(N2CCNC2=O)CC1.
What is the InChIKey of 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is BHAOJIAVKLHNFA-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H30N4O2/c1-2-14-5-3-4-9-20(14)16(22)13-19-10-6-15(7-11-19)21-12-8-18-17(21)23/h14-15H,2-13H2,1H3,(H,18,23)/t14-/m0/s1.
What are the key properties of 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 322.45 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 94424214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).