(4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone

C14H16N2O4 — CID 70721266

IUPAC(4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone
SMILESCOc1ccc2c(c1)cc(C(=O)N1CC(O)CO1)n2C
InChIInChI=1S/C14H16N2O4/c1-15-12-4-3-11(19-2)5-9(12)6-13(15)14(18)16-7-10(17)8-20-16/h3-6,10,17H,7-8H2,1-2H3
InChIKeyUJPBNVZVICQRPS-UHFFFAOYSA-N
MW276.29 g/mol
LogP0.94
Rot. Bonds2

About (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone

(4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone (PubChem CID 70721266) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone.

Molecular Properties

Compound Name(4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone
PubChem CID70721266
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name(4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone
SMILESCOc1ccc2c(c1)cc(C(=O)N1CC(O)CO1)n2C
InChIInChI=1S/C14H16N2O4/c1-15-12-4-3-11(19-2)5-9(12)6-13(15)14(18)16-7-10(17)8-20-16/h3-6,10,17H,7-8H2,1-2H3
InChIKeyUJPBNVZVICQRPS-UHFFFAOYSA-N
XLogP0.94
TPSA63.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(4S)-3,3-dimethyl-4-phenylpyrrolidin-1-yl]-(5-methoxy-1-methylindol-2-yl)methanone
CID 126449791
(9aS)-2-(5-methoxy-1-methylindole-2-carbonyl)-8-methyl-1,3,4,6,7,9a-hexahydropyrazino[1,2-a]pyrazin-9-one
CID 95119899
5-methoxy-1-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]indole-2-carboxamide
CID 56721773
3-[1-(5-methoxy-1-methylindole-2-carbonyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 70727049
(2,6-dimethoxyphenyl)-(4-hydroxy-1,2-oxazolidin-2-yl)methanone
CID 112736663
(2R)-1-(5-methoxy-1-methylindole-2-carbonyl)-N-methylpiperazine-2-carboxamide
CID 124948371
(5-methoxy-1-methylindol-2-yl)-[(2S)-2-(1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 97118078
5-[1-(5-methoxy-1-methylindole-2-carbonyl)pyrrolidin-2-yl]thiophene-2-carboxamide
CID 45244350
[(1S)-1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-(5-methoxy-1-methylindol-2-yl)methanone
CID 97156148
5-methoxy-1-methyl-N-phenylindole-2-carboxamide
CID 10707870
N-(2,3-dihydro-1H-inden-2-yl)-5-methoxy-N,1-dimethylindole-2-carboxamide
CID 70756083
N-(1-aminopropan-2-yl)-5-methoxy-1-methylindole-2-carboxamide
CID 110833437

Frequently Asked Questions

What is the IUPAC name of (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone?
The IUPAC name of (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone (CID 70721266) is (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone.
What is the SMILES notation for (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone?
The canonical SMILES for (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone is COc1ccc2c(c1)cc(C(=O)N1CC(O)CO1)n2C.
What is the InChIKey of (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone?
The InChIKey is UJPBNVZVICQRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-15-12-4-3-11(19-2)5-9(12)6-13(15)14(18)16-7-10(17)8-20-16/h3-6,10,17H,7-8H2,1-2H3.
What are the key properties of (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone?
(4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone has a molecular weight of 276.29 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxy-1,2-oxazolidin-2-yl)-(5-methoxy-1-methylindol-2-yl)methanone is sourced from PubChem (CID 70721266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).