4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine

C19H24N4O — CID 46982060

IUPAC4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine
SMILESCc1ncc(CN2CC(CN3CCOCC3)c3ccccc32)cn1
InChIInChI=1S/C19H24N4O/c1-15-20-10-16(11-21-15)12-23-14-17(13-22-6-8-24-9-7-22)18-4-2-3-5-19(18)23/h2-5,10-11,17H,6-9,12-14H2,1H3
InChIKeyZDKXHGWTKFPBKN-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.22
Rot. Bonds4

About 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine

4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine (PubChem CID 46982060) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine
PubChem CID46982060
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine
SMILESCc1ncc(CN2CC(CN3CCOCC3)c3ccccc32)cn1
InChIInChI=1S/C19H24N4O/c1-15-20-10-16(11-21-15)12-23-14-17(13-22-6-8-24-9-7-22)18-4-2-3-5-19(18)23/h2-5,10-11,17H,6-9,12-14H2,1H3
InChIKeyZDKXHGWTKFPBKN-UHFFFAOYSA-N
XLogP2.22
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine?
The IUPAC name of 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine (CID 46982060) is 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine.
What is the SMILES notation for 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine?
The canonical SMILES for 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine is Cc1ncc(CN2CC(CN3CCOCC3)c3ccccc32)cn1.
What is the InChIKey of 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine?
The InChIKey is ZDKXHGWTKFPBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-15-20-10-16(11-21-15)12-23-14-17(13-22-6-8-24-9-7-22)18-4-2-3-5-19(18)23/h2-5,10-11,17H,6-9,12-14H2,1H3.
What are the key properties of 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine?
4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine has a molecular weight of 324.43 g/mol, XLogP of 2.22, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-[(2-methylpyrimidin-5-yl)methyl]-2,3-dihydroindol-3-yl]methyl]morpholine is sourced from PubChem (CID 46982060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).