(7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone

C18H23FN2O3 — CID 136538978

IUPAC(7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
SMILESCOc1ccc(F)c2[nH]c(C(=O)N3CC(C)(C)OC(C)(C)C3)cc12
InChIInChI=1S/C18H23FN2O3/c1-17(2)9-21(10-18(3,4)24-17)16(22)13-8-11-14(23-5)7-6-12(19)15(11)20-13/h6-8,20H,9-10H2,1-5H3
InChIKeyUJYWDVYDXFDECM-UHFFFAOYSA-N
MW334.39 g/mol
LogP3.35
Rot. Bonds2

About (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone

(7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone (PubChem CID 136538978) has the molecular formula C18H23FN2O3 and a molecular weight of 334.39 g/mol. Its IUPAC name is (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
PubChem CID136538978
Molecular FormulaC18H23FN2O3
Molecular Weight334.39 g/mol
Exact Mass334.17
IUPAC Name(7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
SMILESCOc1ccc(F)c2[nH]c(C(=O)N3CC(C)(C)OC(C)(C)C3)cc12
InChIInChI=1S/C18H23FN2O3/c1-17(2)9-21(10-18(3,4)24-17)16(22)13-8-11-14(23-5)7-6-12(19)15(11)20-13/h6-8,20H,9-10H2,1-5H3
InChIKeyUJYWDVYDXFDECM-UHFFFAOYSA-N
XLogP3.35
TPSA54.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.39
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone with MolForge

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Related Compounds

(7-fluoro-4-methoxy-1H-indol-2-yl)-[4-hydroxy-4-(methoxymethyl)piperidin-1-yl]methanone
CID 139007473
(2S,4S)-1-(7-fluoro-4-methoxy-1H-indole-2-carbonyl)-4-methoxypyrrolidine-2-carboxamide
CID 128983867
2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone
CID 167229545
(5-bromo-2-fluorophenyl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
CID 102743982
[4-(4-fluorophenyl)-1,4-diazepan-1-yl]-(4,6,7-trimethoxy-1H-indol-2-yl)methanone
CID 87042277
(4,7-difluoro-1H-indol-2-yl)-(1-methyl-4,6-dihydropyrrolo[3,4-d]pyrazol-5-yl)methanone
CID 166320882
[(3R,4R)-3,4-diaminopyrrolidin-1-yl]-(7-fluoro-4-methyl-1H-indol-2-yl)methanone
CID 166251917
7-fluoro-4-methoxy-N-[2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-1H-indole-2-carboxamide
CID 166221366
(4,7-dimethoxy-1H-indol-2-yl)-[4-(5-methyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
CID 163340317
(4,7-difluoro-1H-indol-2-yl)-[3-(2-methylphenyl)-2,5-dihydropyrrol-1-yl]methanone
CID 166205131
(4,7-dimethoxy-1H-indol-2-yl)-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)methanone
CID 71826365
7-fluoro-4-methoxy-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]-1H-indole-2-carboxamide
CID 154839549

Frequently Asked Questions

What is the IUPAC name of (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The IUPAC name of (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone (CID 136538978) is (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone.
What is the SMILES notation for (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The canonical SMILES for (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone is COc1ccc(F)c2[nH]c(C(=O)N3CC(C)(C)OC(C)(C)C3)cc12.
What is the InChIKey of (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
The InChIKey is UJYWDVYDXFDECM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN2O3/c1-17(2)9-21(10-18(3,4)24-17)16(22)13-8-11-14(23-5)7-6-12(19)15(11)20-13/h6-8,20H,9-10H2,1-5H3.
What are the key properties of (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone?
(7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone has a molecular weight of 334.39 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone is sourced from PubChem (CID 136538978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).