(1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone

C20H20N2O3 — CID 20954563

IUPAC(1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone
SMILESO=C(C1Cc2ccccc2N1C(=O)c1ccccc1)N1CCOCC1
InChIInChI=1S/C20H20N2O3/c23-19(15-6-2-1-3-7-15)22-17-9-5-4-8-16(17)14-18(22)20(24)21-10-12-25-13-11-21/h1-9,18H,10-14H2
InChIKeyMSJVGSMHOIRMSI-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.12
Rot. Bonds2

About (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone

(1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone (PubChem CID 20954563) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone
PubChem CID20954563
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC Name(1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone
SMILESO=C(C1Cc2ccccc2N1C(=O)c1ccccc1)N1CCOCC1
InChIInChI=1S/C20H20N2O3/c23-19(15-6-2-1-3-7-15)22-17-9-5-4-8-16(17)14-18(22)20(24)21-10-12-25-13-11-21/h1-9,18H,10-14H2
InChIKeyMSJVGSMHOIRMSI-UHFFFAOYSA-N
XLogP2.12
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(1-benzoyl-2,3-dihydroindol-2-yl)-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
CID 20954567
[(2R)-1-benzoyl-2,3-dihydroindol-2-yl]-(4-cyclohexylpiperazin-1-yl)methanone
CID 92710287
(2S)-1-(morpholine-4-carbonyl)-2,3-dihydroindole-2-carboxylic acid
CID 61187329
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
1-(furan-3-carbonyl)-2,3-dihydroindole-2-carboxylic acid
CID 43196856
1-[2-(pyrrolidine-1-carbonyl)-2,3-dihydroindol-1-yl]propan-1-one
CID 20954459
(2S)-2-[(3R)-3-methylpiperidine-1-carbonyl]-2,3-dihydroindole-1-carboxylic acid
CID 69275495
(2S)-1-(3-iodobenzoyl)-2,3-dihydroindole-2-carboxylic acid
CID 28978868
1-[2-(4-ethylpiperazine-1-carbonyl)-2,3-dihydroindol-1-yl]ethanone
CID 20954290
2-[3-(morpholine-4-carbonyl)-3,4-dihydro-2H-quinolin-1-yl]acetic acid
CID 118657178
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-(4-morpholin-4-ylsulfonylphenyl)methanone
CID 1157344
(2R)-1-(4-chlorobenzoyl)-2,3-dihydroindole-2-carboxamide
CID 41428763

Frequently Asked Questions

What is the IUPAC name of (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone?
The IUPAC name of (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone (CID 20954563) is (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone is O=C(C1Cc2ccccc2N1C(=O)c1ccccc1)N1CCOCC1.
What is the InChIKey of (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone?
The InChIKey is MSJVGSMHOIRMSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c23-19(15-6-2-1-3-7-15)22-17-9-5-4-8-16(17)14-18(22)20(24)21-10-12-25-13-11-21/h1-9,18H,10-14H2.
What are the key properties of (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone?
(1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone has a molecular weight of 336.39 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzoyl-2,3-dihydroindol-2-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 20954563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).