(4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone

C16H20N2O4 — CID 86207297

IUPAC(4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone
SMILESCOc1ccc(OC)c2c1cc(C(=O)N1CCOCC1)n2C
InChIInChI=1S/C16H20N2O4/c1-17-12(16(19)18-6-8-22-9-7-18)10-11-13(20-2)4-5-14(21-3)15(11)17/h4-5,10H,6-9H2,1-3H3
InChIKeyVZONLSMDIBKNCY-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.67
Rot. Bonds3

About (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone

(4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone (PubChem CID 86207297) has the molecular formula C16H20N2O4 and a molecular weight of 304.35 g/mol. Its IUPAC name is (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone
PubChem CID86207297
Molecular FormulaC16H20N2O4
Molecular Weight304.35 g/mol
Exact Mass304.14
IUPAC Name(4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone
SMILESCOc1ccc(OC)c2c1cc(C(=O)N1CCOCC1)n2C
InChIInChI=1S/C16H20N2O4/c1-17-12(16(19)18-6-8-22-9-7-18)10-11-13(20-2)4-5-14(21-3)15(11)17/h4-5,10H,6-9H2,1-3H3
InChIKeyVZONLSMDIBKNCY-UHFFFAOYSA-N
XLogP1.67
TPSA52.93 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4,7-dimethoxy-1-methylindole-2-carboxylate
CID 6953965
(3,4-dimethoxyphenyl)-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)methanone
CID 4600615
[2,2-bis(prop-2-enyl)azetidin-1-yl]-(4,7-dimethoxy-1-methylindol-2-yl)methanone
CID 46964895
7-methoxy-1,4-dimethylindole-2-carboxylic acid
CID 83486446
1-(7-methoxy-1,4-dimethylindol-2-yl)ethanone
CID 82372628
methyl 7-methoxy-1,4-dimethylindole-2-carboxylate
CID 132843169
(2-methoxy-6-methylphenyl)-morpholin-4-ylmethanone
CID 131909764
1-[2-[(4,7-dimethoxy-1-methylindole-2-carbonyl)amino]propanoyl]piperidine-4-carboxylic acid
CID 4868605
morpholin-4-yl-(5,6,7-trimethoxy-3,4-dihydronaphthalen-2-yl)methanone
CID 110181392
(2-fluoro-6-methoxyphenyl)-morpholin-4-ylmethanone
CID 65432492
1-(3-fluoro-4-methoxyphenyl)-2-morpholin-4-ylethane-1,2-dione
CID 82122953
(2-methoxy-4-methylsulfanylphenyl)-morpholin-4-ylmethanone
CID 4661838

Frequently Asked Questions

What is the IUPAC name of (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone?
The IUPAC name of (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone (CID 86207297) is (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone is COc1ccc(OC)c2c1cc(C(=O)N1CCOCC1)n2C.
What is the InChIKey of (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone?
The InChIKey is VZONLSMDIBKNCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O4/c1-17-12(16(19)18-6-8-22-9-7-18)10-11-13(20-2)4-5-14(21-3)15(11)17/h4-5,10H,6-9H2,1-3H3.
What are the key properties of (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone?
(4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone has a molecular weight of 304.35 g/mol, XLogP of 1.67, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4,7-dimethoxy-1-methylindol-2-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 86207297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).