2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide

C16H21FN4O2 — CID 119464028

IUPAC2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide
SMILESO=C(NCC1CCCNC1)c1cc(N2CCNC2=O)ccc1F
InChIInChI=1S/C16H21FN4O2/c17-14-4-3-12(21-7-6-19-16(21)23)8-13(14)15(22)20-10-11-2-1-5-18-9-11/h3-4,8,11,18H,1-2,5-7,9-10H2,(H,19,23)(H,20,22)
InChIKeyQRYUJTHDMQADHS-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.08
Rot. Bonds4

About 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide

2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 119464028) has the molecular formula C16H21FN4O2 and a molecular weight of 320.37 g/mol. Its IUPAC name is 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide
PubChem CID119464028
Molecular FormulaC16H21FN4O2
Molecular Weight320.37 g/mol
Exact Mass320.16
IUPAC Name2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide
SMILESO=C(NCC1CCCNC1)c1cc(N2CCNC2=O)ccc1F
InChIInChI=1S/C16H21FN4O2/c17-14-4-3-12(21-7-6-19-16(21)23)8-13(14)15(22)20-10-11-2-1-5-18-9-11/h3-4,8,11,18H,1-2,5-7,9-10H2,(H,19,23)(H,20,22)
InChIKeyQRYUJTHDMQADHS-UHFFFAOYSA-N
XLogP1.08
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119537575
2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-piperidin-3-ylbenzamide;hydrochloride
CID 119428604
2-[[2-fluoro-5-(2-oxoimidazolidin-1-yl)benzoyl]amino]acetic acid
CID 119171429
2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide
CID 120556656
N-[[3-(aminomethyl)-1-fluorocyclobutyl]methyl]-2-fluoro-5-(2-oxoimidazolidin-1-yl)benzamide
CID 167938598
2-fluoro-N-[3-(methylamino)propyl]-5-(2-oxoimidazolidin-1-yl)benzamide;hydrochloride
CID 119433675
2-fluoro-N-methyl-5-(2-oxoimidazolidin-1-yl)-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 124613896
2-bromo-4-fluoro-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462396
4-[[2-fluoro-5-(2-oxoimidazolidin-1-yl)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 119229675
4-fluoro-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462898
5-chloro-2-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 82883859
1-(4-fluorophenyl)-5-methyl-N-(piperidin-3-ylmethyl)pyrazole-4-carboxamide;hydrochloride
CID 119461195

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide (CID 119464028) is 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide is O=C(NCC1CCCNC1)c1cc(N2CCNC2=O)ccc1F.
What is the InChIKey of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is QRYUJTHDMQADHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN4O2/c17-14-4-3-12(21-7-6-19-16(21)23)8-13(14)15(22)20-10-11-2-1-5-18-9-11/h3-4,8,11,18H,1-2,5-7,9-10H2,(H,19,23)(H,20,22).
What are the key properties of 2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide?
2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 320.37 g/mol, XLogP of 1.08, 4 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-ylmethyl)benzamide is sourced from PubChem (CID 119464028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).