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

C17H20N4O — CID 112886644

IUPAC4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine
SMILESCC1Cc2ccccc2N1c1ccnc(N2CCOCC2)n1
InChIInChI=1S/C17H20N4O/c1-13-12-14-4-2-3-5-15(14)21(13)16-6-7-18-17(19-16)20-8-10-22-11-9-20/h2-7,13H,8-12H2,1H3
InChIKeyJQWSYZYESYDPOT-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.40
Rot. Bonds2

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

4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine (PubChem CID 112886644) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine
PubChem CID112886644
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine
SMILESCC1Cc2ccccc2N1c1ccnc(N2CCOCC2)n1
InChIInChI=1S/C17H20N4O/c1-13-12-14-4-2-3-5-15(14)21(13)16-6-7-18-17(19-16)20-8-10-22-11-9-20/h2-7,13H,8-12H2,1H3
InChIKeyJQWSYZYESYDPOT-UHFFFAOYSA-N
XLogP2.40
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-4-yl]-2,3-dihydroindole
CID 112899050
4-[3-(2-methyl-2,3-dihydroindol-1-yl)-1,2,4-triazin-5-yl]morpholine
CID 112944196
8-[2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane
CID 112897459
2-methyl-1-[4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-yl]-2,3-dihydroindole
CID 112898809
N-methyl-4-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyrimidin-2-amine
CID 112902154
4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-2-yl]morpholine
CID 112886562
4-[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 112886572
N-ethyl-4-(2-methyl-2,3-dihydroindol-1-yl)-N-phenylpyrimidin-2-amine
CID 112903002
4-(2-methyl-2,3-dihydroindol-1-yl)-N-(1-phenylethyl)pyrimidin-2-amine
CID 112890774
4-(2-methyl-2,3-dihydroindol-1-yl)-N-(4-methylphenyl)pyrimidin-2-amine
CID 112902001
4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine
CID 112884623
(2-methyl-2,3-dihydroindol-1-yl)-[2-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]methanone
CID 109309496

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine?
The IUPAC name of 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine (CID 112886644) is 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine is CC1Cc2ccccc2N1c1ccnc(N2CCOCC2)n1.
What is the InChIKey of 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine?
The InChIKey is JQWSYZYESYDPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-13-12-14-4-2-3-5-15(14)21(13)16-6-7-18-17(19-16)20-8-10-22-11-9-20/h2-7,13H,8-12H2,1H3.
What are the key properties of 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine?
4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine has a molecular weight of 296.37 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-yl]morpholine is sourced from PubChem (CID 112886644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).