2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride

C15H20ClFN4O2 — CID 119428604

IUPAC2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)c1cc(N2CCNC2=O)ccc1F
InChIInChI=1S/C15H19FN4O2.ClH/c16-13-4-3-11(20-7-6-18-15(20)22)8-12(13)14(21)19-10-2-1-5-17-9-10;/h3-4,8,10,17H,1-2,5-7,9H2,(H,18,22)(H,19,21);1H
InChIKeyNZJYLHGVUBTMCO-UHFFFAOYSA-N
MW342.80 g/mol
LogP1.26
Rot. Bonds3

About 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride

2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride (PubChem CID 119428604) has the molecular formula C15H20ClFN4O2 and a molecular weight of 342.80 g/mol. Its IUPAC name is 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride
PubChem CID119428604
Molecular FormulaC15H20ClFN4O2
Molecular Weight342.80 g/mol
Exact Mass342.13
IUPAC Name2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)c1cc(N2CCNC2=O)ccc1F
InChIInChI=1S/C15H19FN4O2.ClH/c16-13-4-3-11(20-7-6-18-15(20)22)8-12(13)14(21)19-10-2-1-5-17-9-10;/h3-4,8,10,17H,1-2,5-7,9H2,(H,18,22)(H,19,21);1H
InChIKeyNZJYLHGVUBTMCO-UHFFFAOYSA-N
XLogP1.26
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.80
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride?
The IUPAC name of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride (CID 119428604) is 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride.
What is the SMILES notation for 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride?
The canonical SMILES for 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride is Cl.O=C(NC1CCCNC1)c1cc(N2CCNC2=O)ccc1F.
What is the InChIKey of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride?
The InChIKey is NZJYLHGVUBTMCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O2.ClH/c16-13-4-3-11(20-7-6-18-15(20)22)8-12(13)14(21)19-10-2-1-5-17-9-10;/h3-4,8,10,17H,1-2,5-7,9H2,(H,18,22)(H,19,21);1H.
What are the key properties of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride?
2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride has a molecular weight of 342.80 g/mol, XLogP of 1.26, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride is sourced from PubChem (CID 119428604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).