1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one

C22H18FN5O — CID 118937613

IUPAC1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one
SMILESO=C1N(Cc2ccncc2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C22H18FN5O/c23-18-4-1-2-5-21(18)28-20-7-3-6-19(17(20)14-25-28)27-13-12-26(22(27)29)15-16-8-10-24-11-9-16/h1-11,14H,12-13,15H2
InChIKeyAYWCVBWNNRWBHA-UHFFFAOYSA-N
MW387.42 g/mol
LogP4.00
Rot. Bonds4

About 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one

1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one (PubChem CID 118937613) has the molecular formula C22H18FN5O and a molecular weight of 387.42 g/mol. Its IUPAC name is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one
PubChem CID118937613
Molecular FormulaC22H18FN5O
Molecular Weight387.42 g/mol
Exact Mass387.15
IUPAC Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one
SMILESO=C1N(Cc2ccncc2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C22H18FN5O/c23-18-4-1-2-5-21(18)28-20-7-3-6-19(17(20)14-25-28)27-13-12-26(22(27)29)15-16-8-10-24-11-9-16/h1-11,14H,12-13,15H2
InChIKeyAYWCVBWNNRWBHA-UHFFFAOYSA-N
XLogP4.00
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.42
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-fluorophenyl)methyl]-3-(1-methyl-1H-indazol-4-yl)urea
CID 22337693
1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-pyrazol-3-yl)-1H-indol-3-yl]-piperidin-1-yl}-ethyl)-imidazolidin-2-one
CID 11049209
1-(4-Fluorophenyl)-3-[1-[2-(2-oxo-1-imidazolidinyl)ethyl]-4-piperidinyl]-1H-indole
CID 11742071
1-(2-{4-[5-Fluoro-1-(4-fluoro-phenyl)-1H-indol-3-yl]-piperidin-1-yl}-ethyl)-imidazolidin-2-one
CID 15006455
1-Cyclopropyl-3-[[1-(4-fluorobutyl)pyrrolo[3,2-c]pyridin-2-yl]methyl]imidazo[4,5-c]pyridin-2-one
CID 122522802
1-({4-[(1R,5S)-8-azabicyclo[3.2.1]octan-8-yl]-3-fluorophenyl}methyl)-3-1H-indazol-4-ylurea
CID 16749355
1-(2-{4-[6-Fluoro-1-(4-fluoro-phenyl)-1H-indol-3-yl]-piperidin-1-yl}-ethyl)-imidazolidin-2-one
CID 10365032
1-(4-Fluorophenyl)-3-(1-methylpiperidin-4-yl)-5-(2-methylpyrazol-3-yl)indole
CID 71508640
1-(4-Fluorophenyl)-3-(1-methylpiperidin-4-yl)-5-(1-methylpyrazol-3-yl)indole
CID 71508713
3-[[1-(4,4,4-Trifluorobutyl)pyrrolo[3,2-c]pyridin-2-yl]methyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-c]pyridin-2-one
CID 155522586
1-[[3-tert-butyl-1-(3,4-difluorophenyl)pyrazol-5-yl]methyl]-3-(1H-indazol-4-yl)urea
CID 162647847
1-[[3-Tert-butyl-1-[3-(trifluoromethyl)phenyl]pyrazol-5-yl]methyl]-3-(1-methylindazol-4-yl)urea
CID 162655621

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one?
The IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one (CID 118937613) is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one.
What is the SMILES notation for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one?
The canonical SMILES for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one is O=C1N(Cc2ccncc2)CCN1c1cccc2c1cnn2-c1ccccc1F.
What is the InChIKey of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one?
The InChIKey is AYWCVBWNNRWBHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN5O/c23-18-4-1-2-5-21(18)28-20-7-3-6-19(17(20)14-25-28)27-13-12-26(22(27)29)15-16-8-10-24-11-9-16/h1-11,14H,12-13,15H2.
What are the key properties of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one?
1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one has a molecular weight of 387.42 g/mol, XLogP of 4.00, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(pyridin-4-ylmethyl)imidazolidin-2-one is sourced from PubChem (CID 118937613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).