2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide

C16H21FN4O2 — CID 120556656

IUPAC2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide
SMILESCC1CNCCC1NC(=O)c1cc(N2CCNC2=O)ccc1F
InChIInChI=1S/C16H21FN4O2/c1-10-9-18-5-4-14(10)20-15(22)12-8-11(2-3-13(12)17)21-7-6-19-16(21)23/h2-3,8,10,14,18H,4-7,9H2,1H3,(H,19,23)(H,20,22)
InChIKeyRFBSBUXLSXNDNK-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.08
Rot. Bonds3

About 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide

2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide (PubChem CID 120556656) has the molecular formula C16H21FN4O2 and a molecular weight of 320.37 g/mol. Its IUPAC name is 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide
PubChem CID120556656
Molecular FormulaC16H21FN4O2
Molecular Weight320.37 g/mol
Exact Mass320.16
IUPAC Name2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide
SMILESCC1CNCCC1NC(=O)c1cc(N2CCNC2=O)ccc1F
InChIInChI=1S/C16H21FN4O2/c1-10-9-18-5-4-14(10)20-15(22)12-8-11(2-3-13(12)17)21-7-6-19-16(21)23/h2-3,8,10,14,18H,4-7,9H2,1H3,(H,19,23)(H,20,22)
InChIKeyRFBSBUXLSXNDNK-UHFFFAOYSA-N
XLogP1.08
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
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-piperidin-3-ylbenzamide;hydrochloride
CID 119428604
2,5-difluoro-N-[(3S,4R)-3-methylpiperidin-4-yl]benzamide
CID 124516939
5-chloro-2-fluoro-N-(3-methylpiperidin-4-yl)benzamide
CID 120557983
2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119537575
4-[[2-fluoro-5-(2-oxoimidazolidin-1-yl)benzoyl]amino]cyclohexane-1-carboxylic acid
CID 119229675
2,4-difluoro-N-(3-methylpiperidin-4-yl)benzamide
CID 79887319
2-fluoro-5-(2-oxoimidazolidin-1-yl)-N-(piperidin-3-ylmethyl)benzamide
CID 119464028
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-fluoro-5-(2-oxoimidazolidin-1-yl)benzamide;hydrochloride
CID 119459042
2-fluoro-N-methyl-5-(2-oxoimidazolidin-1-yl)-N-[(3R)-pyrrolidin-3-yl]benzamide
CID 124613896
2,3,4-trifluoro-N-(3-methylpiperidin-4-yl)benzamide
CID 79886711
2,3,4-trifluoro-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120556103
2-fluoro-4-(4-fluorophenyl)-N-(3-methylpiperidin-4-yl)benzamide
CID 120555140

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide?
The IUPAC name of 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide (CID 120556656) is 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide.
What is the SMILES notation for 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide?
The canonical SMILES for 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide is CC1CNCCC1NC(=O)c1cc(N2CCNC2=O)ccc1F.
What is the InChIKey of 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide?
The InChIKey is RFBSBUXLSXNDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN4O2/c1-10-9-18-5-4-14(10)20-15(22)12-8-11(2-3-13(12)17)21-7-6-19-16(21)23/h2-3,8,10,14,18H,4-7,9H2,1H3,(H,19,23)(H,20,22).
What are the key properties of 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide?
2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide has a molecular weight of 320.37 g/mol, XLogP of 1.08, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-methylpiperidin-4-yl)-5-(2-oxoimidazolidin-1-yl)benzamide is sourced from PubChem (CID 120556656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).