3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide

C19H18N6O2 — CID 51129993

IUPAC3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide
SMILESO=C(Nc1ccn(Cc2ccncc2)n1)c1cccc(N2CCNC2=O)c1
InChIInChI=1S/C19H18N6O2/c26-18(15-2-1-3-16(12-15)25-11-9-21-19(25)27)22-17-6-10-24(23-17)13-14-4-7-20-8-5-14/h1-8,10,12H,9,11,13H2,(H,21,27)(H,22,23,26)
InChIKeyGPOCVNBFMPIWJW-UHFFFAOYSA-N
MW362.39 g/mol
LogP2.11
Rot. Bonds5

About 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide

3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide (PubChem CID 51129993) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide.

Molecular Properties

Compound Name3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide
PubChem CID51129993
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC Name3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide
SMILESO=C(Nc1ccn(Cc2ccncc2)n1)c1cccc(N2CCNC2=O)c1
InChIInChI=1S/C19H18N6O2/c26-18(15-2-1-3-16(12-15)25-11-9-21-19(25)27)22-17-6-10-24(23-17)13-14-4-7-20-8-5-14/h1-8,10,12H,9,11,13H2,(H,21,27)(H,22,23,26)
InChIKeyGPOCVNBFMPIWJW-UHFFFAOYSA-N
XLogP2.11
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide?
The IUPAC name of 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide (CID 51129993) is 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide.
What is the SMILES notation for 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide?
The canonical SMILES for 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide is O=C(Nc1ccn(Cc2ccncc2)n1)c1cccc(N2CCNC2=O)c1.
What is the InChIKey of 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide?
The InChIKey is GPOCVNBFMPIWJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c26-18(15-2-1-3-16(12-15)25-11-9-21-19(25)27)22-17-6-10-24(23-17)13-14-4-7-20-8-5-14/h1-8,10,12H,9,11,13H2,(H,21,27)(H,22,23,26).
What are the key properties of 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide?
3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide has a molecular weight of 362.39 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxoimidazolidin-1-yl)-N-[1-(pyridin-4-ylmethyl)pyrazol-3-yl]benzamide is sourced from PubChem (CID 51129993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).