[(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone

C22H20N4O2 — CID 178095206

IUPAC[(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone
SMILESO=C(c1c[nH]c2cc(-c3cn[nH]c3)ccc12)N1CCOC[C@@H]1c1ccccc1
InChIInChI=1S/C22H20N4O2/c27-22(26-8-9-28-14-21(26)15-4-2-1-3-5-15)19-13-23-20-10-16(6-7-18(19)20)17-11-24-25-12-17/h1-7,10-13,21,23H,8-9,14H2,(H,24,25)/t21-/m1/s1
InChIKeyFCRBFYLHFKTMDM-OAQYLSRUSA-N
MW372.43 g/mol
LogP3.77
Rot. Bonds3

About [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone

[(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone (PubChem CID 178095206) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone.

Molecular Properties

Compound Name[(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone
PubChem CID178095206
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC Name[(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone
SMILESO=C(c1c[nH]c2cc(-c3cn[nH]c3)ccc12)N1CCOC[C@@H]1c1ccccc1
InChIInChI=1S/C22H20N4O2/c27-22(26-8-9-28-14-21(26)15-4-2-1-3-5-15)19-13-23-20-10-16(6-7-18(19)20)17-11-24-25-12-17/h1-7,10-13,21,23H,8-9,14H2,(H,24,25)/t21-/m1/s1
InChIKeyFCRBFYLHFKTMDM-OAQYLSRUSA-N
XLogP3.77
TPSA74.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone 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

[3-(3-chlorophenyl)morpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone
CID 178095431
[3-(3-methoxyphenyl)morpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone
CID 178094970
[(3S)-3-[3-(difluoromethoxy)phenyl]morpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methanone
CID 178094971
[2-(2-fluorophenyl)pyrrolidin-1-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone
CID 178095115
(3-phenylpyrrolidin-1-yl)-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone;2,2,2-trifluoroacetic acid
CID 117078074
[(2R)-2-phenylazetidin-1-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-2-yl]methanone
CID 178095072
[(3S)-3-(2-fluorophenyl)morpholin-4-yl]-[1-methyl-6-(1H-pyrazol-4-yl)pyrrolo[2,3-b]pyridin-3-yl]methanone
CID 178095297
[(3S)-3-(3-chlorophenyl)morpholin-4-yl]-[1-methyl-6-(1H-pyrazol-4-yl)pyrrolo[2,3-b]pyridin-2-yl]methanone
CID 178095065
[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-(3-phenylmorpholin-4-yl)methanone
CID 71866643
(4-fluorophenyl)-(3-phenylmorpholin-4-yl)methanone
CID 110728336
[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]-(3-phenylmorpholin-4-yl)methanone
CID 146229731
[4,5-dimethyl-6-[2-(1H-pyrazol-4-yl)ethylamino]pyrimidin-2-yl]-(3-phenylmorpholin-4-yl)methanone
CID 170692829

Frequently Asked Questions

What is the IUPAC name of [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone?
The IUPAC name of [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone (CID 178095206) is [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone.
What is the SMILES notation for [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone?
The canonical SMILES for [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone is O=C(c1c[nH]c2cc(-c3cn[nH]c3)ccc12)N1CCOC[C@@H]1c1ccccc1.
What is the InChIKey of [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone?
The InChIKey is FCRBFYLHFKTMDM-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H20N4O2/c27-22(26-8-9-28-14-21(26)15-4-2-1-3-5-15)19-13-23-20-10-16(6-7-18(19)20)17-11-24-25-12-17/h1-7,10-13,21,23H,8-9,14H2,(H,24,25)/t21-/m1/s1.
What are the key properties of [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone?
[(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone has a molecular weight of 372.43 g/mol, XLogP of 3.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3-phenylmorpholin-4-yl]-[6-(1H-pyrazol-4-yl)-1H-indol-3-yl]methanone is sourced from PubChem (CID 178095206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).