N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine

C20H18F2N4 — CID 112879061

IUPACN-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine
SMILESCc1nc(Nc2ccc(F)cc2F)cc(N2c3ccccc3CC2C)n1
InChIInChI=1S/C20H18F2N4/c1-12-9-14-5-3-4-6-18(14)26(12)20-11-19(23-13(2)24-20)25-17-8-7-15(21)10-16(17)22/h3-8,10-12H,9H2,1-2H3,(H,23,24,25)
InChIKeyAUTUEDBTDSDGGP-UHFFFAOYSA-N
MW352.39 g/mol
LogP4.89
Rot. Bonds3

About N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine

N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine (PubChem CID 112879061) has the molecular formula C20H18F2N4 and a molecular weight of 352.39 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine
PubChem CID112879061
Molecular FormulaC20H18F2N4
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC NameN-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine
SMILESCc1nc(Nc2ccc(F)cc2F)cc(N2c3ccccc3CC2C)n1
InChIInChI=1S/C20H18F2N4/c1-12-9-14-5-3-4-6-18(14)26(12)20-11-19(23-13(2)24-20)25-17-8-7-15(21)10-16(17)22/h3-8,10-12H,9H2,1-2H3,(H,23,24,25)
InChIKeyAUTUEDBTDSDGGP-UHFFFAOYSA-N
XLogP4.89
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]amino]benzoic acid
CID 113194954
N-(2-fluorophenyl)-4-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine
CID 112929425
4-[[2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]amino]benzoic acid
CID 113193343
N-(2,4-difluorophenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 112868570
1-[6-(azepan-1-yl)-2-methylpyrimidin-4-yl]-2-methyl-2,3-dihydroindole
CID 112876835
N-[(4-fluorophenyl)methyl]-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109369937
N-(2,6-difluorophenyl)-4-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine
CID 112932172
N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine
CID 80753740
N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine
CID 80755891
1-[2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]-3,4-dihydro-2H-quinoline
CID 112877328
4-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-N-(2-methylphenyl)pyrimidin-2-amine
CID 112927146
N-tert-butyl-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-4-carboxamide
CID 109373876

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine?
The IUPAC name of N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine (CID 112879061) is N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine?
The canonical SMILES for N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine is Cc1nc(Nc2ccc(F)cc2F)cc(N2c3ccccc3CC2C)n1.
What is the InChIKey of N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine?
The InChIKey is AUTUEDBTDSDGGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18F2N4/c1-12-9-14-5-3-4-6-18(14)26(12)20-11-19(23-13(2)24-20)25-17-8-7-15(21)10-16(17)22/h3-8,10-12H,9H2,1-2H3,(H,23,24,25).
What are the key properties of N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine?
N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine has a molecular weight of 352.39 g/mol, XLogP of 4.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 112879061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).