3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one

C19H24N4O2 — CID 110105309

IUPAC3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one
SMILESCc1cnc(C2CN(C(=O)CCN3CCc4ccccc43)CCO2)[nH]1
InChIInChI=1S/C19H24N4O2/c1-14-12-20-19(21-14)17-13-23(10-11-25-17)18(24)7-9-22-8-6-15-4-2-3-5-16(15)22/h2-5,12,17H,6-11,13H2,1H3,(H,20,21)
InChIKeyPWKKDIGRWJHSJL-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.07
Rot. Bonds4

About 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one

3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one (PubChem CID 110105309) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one
PubChem CID110105309
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one
SMILESCc1cnc(C2CN(C(=O)CCN3CCc4ccccc43)CCO2)[nH]1
InChIInChI=1S/C19H24N4O2/c1-14-12-20-19(21-14)17-13-23(10-11-25-17)18(24)7-9-22-8-6-15-4-2-3-5-16(15)22/h2-5,12,17H,6-11,13H2,1H3,(H,20,21)
InChIKeyPWKKDIGRWJHSJL-UHFFFAOYSA-N
XLogP2.07
TPSA61.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one with MolForge

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Related Compounds

1-[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-3-phenylpropan-1-one
CID 124972553
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-3-thiophen-2-ylpropan-1-one
CID 124960617
2-cyclopropyl-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 73439823
3-(1H-indol-3-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one
CID 155899693
2-(2,3-dihydro-1H-inden-5-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 110105208
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone
CID 124995684
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-morpholin-4-ylethanone
CID 124953608
[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-(1-methylpiperidin-4-yl)methanone
CID 124947783
3-(3-methoxy-1,2-oxazol-5-yl)-1-[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one
CID 125008071
3-(3,4-dihydro-2H-quinolin-1-yl)-1-[2-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]morpholin-4-yl]propan-1-one
CID 127249793
2-(4-methoxyphenyl)-1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 124978039
1-[2-[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-oxoethyl]pyrimidin-2-one
CID 125013405

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one?
The IUPAC name of 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one (CID 110105309) is 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one.
What is the SMILES notation for 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one?
The canonical SMILES for 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one is Cc1cnc(C2CN(C(=O)CCN3CCc4ccccc43)CCO2)[nH]1.
What is the InChIKey of 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one?
The InChIKey is PWKKDIGRWJHSJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-12-20-19(21-14)17-13-23(10-11-25-17)18(24)7-9-22-8-6-15-4-2-3-5-16(15)22/h2-5,12,17H,6-11,13H2,1H3,(H,20,21).
What are the key properties of 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one?
3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one has a molecular weight of 340.43 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one is sourced from PubChem (CID 110105309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).