1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one

C24H26ClFN4O — CID 10094822

IUPAC1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCN1CCC(n2cc(-c3ccc(F)cc3)c3ccc(Cl)cc32)CC1
InChIInChI=1S/C24H26ClFN4O/c25-18-3-6-21-22(17-1-4-19(26)5-2-17)16-30(23(21)15-18)20-7-10-28(11-8-20)13-14-29-12-9-27-24(29)31/h1-6,15-16,20H,7-14H2,(H,27,31)
InChIKeyIXWMONQJSSRIPH-UHFFFAOYSA-N
MW440.95 g/mol
LogP4.76
Rot. Bonds5

About 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one

1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one (PubChem CID 10094822) has the molecular formula C24H26ClFN4O and a molecular weight of 440.95 g/mol. Its IUPAC name is 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
PubChem CID10094822
Molecular FormulaC24H26ClFN4O
Molecular Weight440.95 g/mol
Exact Mass440.18
IUPAC Name1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCN1CCC(n2cc(-c3ccc(F)cc3)c3ccc(Cl)cc32)CC1
InChIInChI=1S/C24H26ClFN4O/c25-18-3-6-21-22(17-1-4-19(26)5-2-17)16-30(23(21)15-18)20-7-10-28(11-8-20)13-14-29-12-9-27-24(29)31/h1-6,15-16,20H,7-14H2,(H,27,31)
InChIKeyIXWMONQJSSRIPH-UHFFFAOYSA-N
XLogP4.76
TPSA40.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.95
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one (CID 10094822) is 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one is O=C1NCCN1CCN1CCC(n2cc(-c3ccc(F)cc3)c3ccc(Cl)cc32)CC1.
What is the InChIKey of 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The InChIKey is IXWMONQJSSRIPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26ClFN4O/c25-18-3-6-21-22(17-1-4-19(26)5-2-17)16-30(23(21)15-18)20-7-10-28(11-8-20)13-14-29-12-9-27-24(29)31/h1-6,15-16,20H,7-14H2,(H,27,31).
What are the key properties of 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one has a molecular weight of 440.95 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-[6-chloro-3-(4-fluorophenyl)indol-1-yl]piperidin-1-yl]ethyl]imidazolidin-2-one is sourced from PubChem (CID 10094822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).