1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one

C22H17NO3 — CID 132600722

IUPAC1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one
SMILESCOc1cc2c(c(O)c1C)C1(C(=O)Nc3ccccc31)c1ccccc1-2
InChIInChI=1S/C22H17NO3/c1-12-18(26-2)11-14-13-7-3-4-8-15(13)22(19(14)20(12)24)16-9-5-6-10-17(16)23-21(22)25/h3-11,24H,1-2H3,(H,23,25)
InChIKeyFQQVKODNRVDRQI-UHFFFAOYSA-N
MW343.38 g/mol
LogP3.98
Rot. Bonds1

About 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one

1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one (PubChem CID 132600722) has the molecular formula C22H17NO3 and a molecular weight of 343.38 g/mol. Its IUPAC name is 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one.

Molecular Properties

Compound Name1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one
PubChem CID132600722
Molecular FormulaC22H17NO3
Molecular Weight343.38 g/mol
Exact Mass343.12
IUPAC Name1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one
SMILESCOc1cc2c(c(O)c1C)C1(C(=O)Nc3ccccc31)c1ccccc1-2
InChIInChI=1S/C22H17NO3/c1-12-18(26-2)11-14-13-7-3-4-8-15(13)22(19(14)20(12)24)16-9-5-6-10-17(16)23-21(22)25/h3-11,24H,1-2H3,(H,23,25)
InChIKeyFQQVKODNRVDRQI-UHFFFAOYSA-N
XLogP3.98
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,3-bis(2-hydroxy-3-methylphenyl)-1H-indol-2-one
CID 54065813
3-(4-hydroxy-3-methylphenyl)-3-phenyl-1H-indol-2-one
CID 11558717
(3R)-3-hydroxy-3-(2-methoxyphenyl)-1H-indol-2-one
CID 7333204
spiro[10H-acridine-9,9'-fluorene]
CID 13293439
2'-(4-methoxyphenyl)spiro[1H-indole-3,12'-2-azapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),3(11),4,6,8,15,17,19-octaene]-2,10',14'-trione
CID 101495320
(3R)-3-hydroxy-3-[(2S)-6-methoxy-5-methyl-1-oxo-3,4-dihydro-2H-naphthalen-2-yl]-1H-indol-2-one
CID 838892
3-(2-methoxyphenyl)-3-(2-methylprop-2-enyl)-1H-indol-2-one
CID 166807949
3,3-bis(2-hydroxy-5-propan-2-yloxyphenyl)-1H-indol-2-one
CID 90080203
(2'S,3R)-2'-(2,4-dimethoxyphenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
CID 52905379
3-(2-hydroxy-4-methylphenyl)-3-(4-hydroxy-2-methylphenyl)-1H-indol-2-one
CID 165341869
3-hydroxy-3-(2-hydroxy-5-methoxyphenyl)-1H-indol-2-one
CID 15857499
(3S)-3-hydroxy-3-[methoxy(methyl)phosphoryl]oxy-1H-indol-2-one
CID 125471731

Frequently Asked Questions

What is the IUPAC name of 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one?
The IUPAC name of 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one (CID 132600722) is 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one.
What is the SMILES notation for 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one?
The canonical SMILES for 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one is COc1cc2c(c(O)c1C)C1(C(=O)Nc3ccccc31)c1ccccc1-2.
What is the InChIKey of 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one?
The InChIKey is FQQVKODNRVDRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO3/c1-12-18(26-2)11-14-13-7-3-4-8-15(13)22(19(14)20(12)24)16-9-5-6-10-17(16)23-21(22)25/h3-11,24H,1-2H3,(H,23,25).
What are the key properties of 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one?
1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one has a molecular weight of 343.38 g/mol, XLogP of 3.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-hydroxy-3'-methoxy-2'-methylspiro[1H-indole-3,9'-fluorene]-2-one is sourced from PubChem (CID 132600722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).