1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole

C14H15N3O — CID 43817662

IUPAC1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole
SMILESCOc1cc(C)nc(N2CCc3ccccc32)n1
InChIInChI=1S/C14H15N3O/c1-10-9-13(18-2)16-14(15-10)17-8-7-11-5-3-4-6-12(11)17/h3-6,9H,7-8H2,1-2H3
InChIKeyUDIDOHULVMNZIL-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.49
Rot. Bonds2

About 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole

1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole (PubChem CID 43817662) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole.

Molecular Properties

Compound Name1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole
PubChem CID43817662
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole
SMILESCOc1cc(C)nc(N2CCc3ccccc32)n1
InChIInChI=1S/C14H15N3O/c1-10-9-13(18-2)16-14(15-10)17-8-7-11-5-3-4-6-12(11)17/h3-6,9H,7-8H2,1-2H3
InChIKeyUDIDOHULVMNZIL-UHFFFAOYSA-N
XLogP2.49
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl]-2,3-dihydroindole
CID 112923655
N-(4-chlorophenyl)-2-(2,3-dihydroindol-1-yl)-6-methylpyrimidin-4-amine
CID 112927774
1-[6-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-2,3-dihydroindole
CID 112914025
methyl 3-[[2-(2,3-dihydroindol-1-yl)-6-methylpyrimidin-4-yl]amino]benzoate
CID 112927803
2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(4-methoxyphenyl)methyl]-6-methylpyrimidin-4-amine
CID 112918466
[2-(2,3-dihydroindol-1-yl)-6-methylpyrimidin-4-yl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109335434
2-(2,3-dihydroindol-1-yl)-N-(3,5-dimethylphenyl)-6-methylpyrimidine-4-carboxamide
CID 109335380
[2-(2,3-dihydroindol-1-yl)-6-methylpyrimidin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 109331562
N-(2,6-difluorophenyl)-2-(2,3-dihydroindol-1-yl)-6-methylpyrimidine-4-carboxamide
CID 109335446
N-cycloheptyl-2-(3,4-dihydro-2H-quinolin-1-yl)-6-methylpyrimidin-4-amine
CID 112924885
N-[2-(3-chlorophenyl)ethyl]-2-(2,3-dihydroindol-1-yl)-6-methylpyrimidin-4-amine
CID 112926469
N-(4-chloro-2-methylphenyl)-2-(2,3-dihydroindol-1-yl)-6-methylpyrimidine-4-carboxamide
CID 109335400

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole?
The IUPAC name of 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole (CID 43817662) is 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole.
What is the SMILES notation for 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole?
The canonical SMILES for 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole is COc1cc(C)nc(N2CCc3ccccc32)n1.
What is the InChIKey of 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole?
The InChIKey is UDIDOHULVMNZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-10-9-13(18-2)16-14(15-10)17-8-7-11-5-3-4-6-12(11)17/h3-6,9H,7-8H2,1-2H3.
What are the key properties of 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole?
1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole has a molecular weight of 241.29 g/mol, XLogP of 2.49, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-6-methylpyrimidin-2-yl)-2,3-dihydroindole is sourced from PubChem (CID 43817662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).