2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide

C16H17F2N5O2 — CID 71998623

IUPAC2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide
SMILESCCCc1cc(NC(=O)c2cc(N3CCNC3=O)c(F)cc2F)n[nH]1
InChIInChI=1S/C16H17F2N5O2/c1-2-3-9-6-14(22-21-9)20-15(24)10-7-13(12(18)8-11(10)17)23-5-4-19-16(23)25/h6-8H,2-5H2,1H3,(H,19,25)(H2,20,21,22,24)
InChIKeyICKLUUCXACEHFK-UHFFFAOYSA-N
MW349.34 g/mol
LogP2.42
Rot. Bonds5

About 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide

2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide (PubChem CID 71998623) has the molecular formula C16H17F2N5O2 and a molecular weight of 349.34 g/mol. Its IUPAC name is 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide.

Molecular Properties

Compound Name2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide
PubChem CID71998623
Molecular FormulaC16H17F2N5O2
Molecular Weight349.34 g/mol
Exact Mass349.14
IUPAC Name2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide
SMILESCCCc1cc(NC(=O)c2cc(N3CCNC3=O)c(F)cc2F)n[nH]1
InChIInChI=1S/C16H17F2N5O2/c1-2-3-9-6-14(22-21-9)20-15(24)10-7-13(12(18)8-11(10)17)23-5-4-19-16(23)25/h6-8H,2-5H2,1H3,(H,19,25)(H2,20,21,22,24)
InChIKeyICKLUUCXACEHFK-UHFFFAOYSA-N
XLogP2.42
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.34
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide?
The IUPAC name of 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide (CID 71998623) is 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide.
What is the SMILES notation for 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide?
The canonical SMILES for 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide is CCCc1cc(NC(=O)c2cc(N3CCNC3=O)c(F)cc2F)n[nH]1.
What is the InChIKey of 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide?
The InChIKey is ICKLUUCXACEHFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F2N5O2/c1-2-3-9-6-14(22-21-9)20-15(24)10-7-13(12(18)8-11(10)17)23-5-4-19-16(23)25/h6-8H,2-5H2,1H3,(H,19,25)(H2,20,21,22,24).
What are the key properties of 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide?
2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide has a molecular weight of 349.34 g/mol, XLogP of 2.42, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-5-(2-oxoimidazolidin-1-yl)-N-(5-propyl-1H-pyrazol-3-yl)benzamide is sourced from PubChem (CID 71998623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).