3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide

C17H17ClN4O2 — CID 178108892

IUPAC3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide
SMILESCCc1c(Cl)ccnc1N1CCN(c2cccc(C(N)=O)c2)C1=O
InChIInChI=1S/C17H17ClN4O2/c1-2-13-14(18)6-7-20-16(13)22-9-8-21(17(22)24)12-5-3-4-11(10-12)15(19)23/h3-7,10H,2,8-9H2,1H3,(H2,19,23)
InChIKeyFWXMLWGQYAEKQW-UHFFFAOYSA-N
MW344.80 g/mol
LogP2.84
Rot. Bonds4

About 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide

3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide (PubChem CID 178108892) has the molecular formula C17H17ClN4O2 and a molecular weight of 344.80 g/mol. Its IUPAC name is 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide.

Molecular Properties

Compound Name3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide
PubChem CID178108892
Molecular FormulaC17H17ClN4O2
Molecular Weight344.80 g/mol
Exact Mass344.10
IUPAC Name3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide
SMILESCCc1c(Cl)ccnc1N1CCN(c2cccc(C(N)=O)c2)C1=O
InChIInChI=1S/C17H17ClN4O2/c1-2-13-14(18)6-7-20-16(13)22-9-8-21(17(22)24)12-5-3-4-11(10-12)15(19)23/h3-7,10H,2,8-9H2,1H3,(H2,19,23)
InChIKeyFWXMLWGQYAEKQW-UHFFFAOYSA-N
XLogP2.84
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.80
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide?
The IUPAC name of 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide (CID 178108892) is 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide.
What is the SMILES notation for 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide?
The canonical SMILES for 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide is CCc1c(Cl)ccnc1N1CCN(c2cccc(C(N)=O)c2)C1=O.
What is the InChIKey of 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide?
The InChIKey is FWXMLWGQYAEKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN4O2/c1-2-13-14(18)6-7-20-16(13)22-9-8-21(17(22)24)12-5-3-4-11(10-12)15(19)23/h3-7,10H,2,8-9H2,1H3,(H2,19,23).
What are the key properties of 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide?
3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide has a molecular weight of 344.80 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(4-chloro-3-ethyl-2-pyridinyl)-2-oxoimidazolidin-1-yl]benzamide is sourced from PubChem (CID 178108892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).