1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one

C15H18F3N5O2 — CID 9288360

IUPAC1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one
SMILESO=C(CN1CCN(c2ccc(C(F)(F)F)cn2)CC1)N1CCNC1=O
InChIInChI=1S/C15H18F3N5O2/c16-15(17,18)11-1-2-12(20-9-11)22-7-5-21(6-8-22)10-13(24)23-4-3-19-14(23)25/h1-2,9H,3-8,10H2,(H,19,25)
InChIKeyAYDSDGXMUILGCK-UHFFFAOYSA-N
MW357.34 g/mol
LogP0.77
Rot. Bonds3

About 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one

1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one (PubChem CID 9288360) has the molecular formula C15H18F3N5O2 and a molecular weight of 357.34 g/mol. Its IUPAC name is 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one
PubChem CID9288360
Molecular FormulaC15H18F3N5O2
Molecular Weight357.34 g/mol
Exact Mass357.14
IUPAC Name1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one
SMILESO=C(CN1CCN(c2ccc(C(F)(F)F)cn2)CC1)N1CCNC1=O
InChIInChI=1S/C15H18F3N5O2/c16-15(17,18)11-1-2-12(20-9-11)22-7-5-21(6-8-22)10-13(24)23-4-3-19-14(23)25/h1-2,9H,3-8,10H2,(H,19,25)
InChIKeyAYDSDGXMUILGCK-UHFFFAOYSA-N
XLogP0.77
TPSA68.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.34
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(azepan-1-yl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethanone
CID 78788182
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethanone
CID 9288459
N,N-diethyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetamide
CID 78788187
3-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propanamide
CID 38559713
1-(2,6-dimethylpiperidin-1-yl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]ethanone
CID 55412875
N-methyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]acetamide
CID 51561809
N,N-di(propan-2-yl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]acetamide
CID 55412772
N-(4-methylphenyl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetamide
CID 29107496
N-prop-2-enyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetamide
CID 38522896
1-(4-methoxyphenyl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethanone
CID 2810008
N-butyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetamide
CID 9288574
1-[4-[5-[4-(trifluoromethyl)phenyl]-2-pyridinyl]piperazin-1-yl]propan-2-one
CID 58006657

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one (CID 9288360) is 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one is O=C(CN1CCN(c2ccc(C(F)(F)F)cn2)CC1)N1CCNC1=O.
What is the InChIKey of 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one?
The InChIKey is AYDSDGXMUILGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F3N5O2/c16-15(17,18)11-1-2-12(20-9-11)22-7-5-21(6-8-22)10-13(24)23-4-3-19-14(23)25/h1-2,9H,3-8,10H2,(H,19,25).
What are the key properties of 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one?
1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one has a molecular weight of 357.34 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]acetyl]imidazolidin-2-one is sourced from PubChem (CID 9288360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).