(2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one

C24H28N2O3 — CID 173085330

IUPAC(2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one
SMILESCc1cc2ccccc2n1Cc1cccc(CO[C@H](C)C(=O)N2CCOCC2)c1
InChIInChI=1S/C24H28N2O3/c1-18-14-22-8-3-4-9-23(22)26(18)16-20-6-5-7-21(15-20)17-29-19(2)24(27)25-10-12-28-13-11-25/h3-9,14-15,19H,10-13,16-17H2,1-2H3/t19-/m1/s1
InChIKeyVEDNCVARSCMEPR-LJQANCHMSA-N
MW392.50 g/mol
LogP3.76
Rot. Bonds6

About (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one

(2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one (PubChem CID 173085330) has the molecular formula C24H28N2O3 and a molecular weight of 392.50 g/mol. Its IUPAC name is (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name(2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one
PubChem CID173085330
Molecular FormulaC24H28N2O3
Molecular Weight392.50 g/mol
Exact Mass392.21
IUPAC Name(2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one
SMILESCc1cc2ccccc2n1Cc1cccc(CO[C@H](C)C(=O)N2CCOCC2)c1
InChIInChI=1S/C24H28N2O3/c1-18-14-22-8-3-4-9-23(22)26(18)16-20-6-5-7-21(15-20)17-29-19(2)24(27)25-10-12-28-13-11-25/h3-9,14-15,19H,10-13,16-17H2,1-2H3/t19-/m1/s1
InChIKeyVEDNCVARSCMEPR-LJQANCHMSA-N
XLogP3.76
TPSA43.70 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one with MolForge

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Related Compounds

(2R)-1-morpholin-4-yl-2-phenylmethoxypropan-1-one
CID 165346158
2-(2-methylindol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]acetamide
CID 47776662
2-phenylmethoxy-1-pyrrolidin-1-ylpropan-1-one
CID 14373623
1-[2-(hydroxymethyl)morpholin-4-yl]-2-phenylmethoxypropan-1-one
CID 81208321
[1-[[1-[(3-chlorophenyl)methyl]indol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 50807615
1-(3-hydroxypiperidin-1-yl)-2-phenylmethoxypropan-1-one
CID 43428067
1-[(3,4-dichlorophenyl)methyl]-2-methylindole
CID 63812577
benzyl N-[(2S)-1-oxo-1-[16-[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]propan-2-yl]carbamate
CID 13291357
(2S)-2-(3-methoxyphenoxy)-1-morpholin-4-ylpropan-1-one
CID 92679202
(1-morpholin-4-yl-1-oxopropan-2-yl) 3-[(2-oxopyrrolidin-1-yl)methyl]benzoate
CID 55426814
(1-morpholin-4-yl-1-oxopropan-2-yl) 3-(methylsulfinylmethyl)benzoate
CID 55456096
(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(4-phenylmethoxyphenoxy)acetate
CID 55317024

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one (CID 173085330) is (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one is Cc1cc2ccccc2n1Cc1cccc(CO[C@H](C)C(=O)N2CCOCC2)c1.
What is the InChIKey of (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one?
The InChIKey is VEDNCVARSCMEPR-LJQANCHMSA-N. The full InChI is InChI=1S/C24H28N2O3/c1-18-14-22-8-3-4-9-23(22)26(18)16-20-6-5-7-21(15-20)17-29-19(2)24(27)25-10-12-28-13-11-25/h3-9,14-15,19H,10-13,16-17H2,1-2H3/t19-/m1/s1.
What are the key properties of (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one?
(2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one has a molecular weight of 392.50 g/mol, XLogP of 3.76, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[3-[(2-methylindol-1-yl)methyl]phenyl]methoxy]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 173085330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).