1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one

C26H28FN7O — CID 11123573

IUPAC1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCN1CCC(c2cn(-c3ccc(F)cc3)c3ccc(-c4cn[nH]n4)cc23)CC1
InChIInChI=1S/C26H28FN7O/c27-20-2-4-21(5-3-20)34-17-23(22-15-19(1-6-25(22)34)24-16-29-31-30-24)18-7-10-32(11-8-18)13-14-33-12-9-28-26(33)35/h1-6,15-18H,7-14H2,(H,28,35)(H,29,30,31)
InChIKeyTZCZMKAONNBNIA-UHFFFAOYSA-N
MW473.56 g/mol
LogP3.76
Rot. Bonds6

About 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one

1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one (PubChem CID 11123573) has the molecular formula C26H28FN7O and a molecular weight of 473.56 g/mol. Its IUPAC name is 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
PubChem CID11123573
Molecular FormulaC26H28FN7O
Molecular Weight473.56 g/mol
Exact Mass473.23
IUPAC Name1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCN1CCC(c2cn(-c3ccc(F)cc3)c3ccc(-c4cn[nH]n4)cc23)CC1
InChIInChI=1S/C26H28FN7O/c27-20-2-4-21(5-3-20)34-17-23(22-15-19(1-6-25(22)34)24-16-29-31-30-24)18-7-10-32(11-8-18)13-14-33-12-9-28-26(33)35/h1-6,15-18H,7-14H2,(H,28,35)(H,29,30,31)
InChIKeyTZCZMKAONNBNIA-UHFFFAOYSA-N
XLogP3.76
TPSA82.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.56
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-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

Related Compounds

CID 9826801
CID 9826801
CID 9913988
CID 9913988
CID 9932698
CID 9932698
CID 10387431
CID 10387431
CID 10917920
CID 10917920
CID 11049209
CID 11049209
CID 11742071
CID 11742071
CID 11742887
CID 11742887
CID 15006455
CID 15006455
CID 15006457
CID 15006457
CID 15006458
CID 15006458
CID 164625965
CID 164625965

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one (CID 11123573) is 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one is O=C1NCCN1CCN1CCC(c2cn(-c3ccc(F)cc3)c3ccc(-c4cn[nH]n4)cc23)CC1.
What is the InChIKey of 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The InChIKey is TZCZMKAONNBNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28FN7O/c27-20-2-4-21(5-3-20)34-17-23(22-15-19(1-6-25(22)34)24-16-29-31-30-24)18-7-10-32(11-8-18)13-14-33-12-9-28-26(33)35/h1-6,15-18H,7-14H2,(H,28,35)(H,29,30,31).
What are the key properties of 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one?
1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one has a molecular weight of 473.56 g/mol, XLogP of 3.76, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-[1-(4-fluorophenyl)-5-(2H-triazol-4-yl)indol-3-yl]piperidin-1-yl]ethyl]imidazolidin-2-one is sourced from PubChem (CID 11123573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).