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

C15H18N4S — CID 80753740

IUPACN-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine
SMILESCNc1cc(N2c3ccccc3CC2C)nc(SC)n1
InChIInChI=1S/C15H18N4S/c1-10-8-11-6-4-5-7-12(11)19(10)14-9-13(16-2)17-15(18-14)20-3/h4-7,9-10H,8H2,1-3H3,(H,16,17,18)
InChIKeyPDRLYQQHJZSGFH-UHFFFAOYSA-N
MW286.40 g/mol
LogP3.32
Rot. Bonds3

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

N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine (PubChem CID 80753740) has the molecular formula C15H18N4S and a molecular weight of 286.40 g/mol. Its IUPAC name is N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine
PubChem CID80753740
Molecular FormulaC15H18N4S
Molecular Weight286.40 g/mol
Exact Mass286.13
IUPAC NameN-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine
SMILESCNc1cc(N2c3ccccc3CC2C)nc(SC)n1
InChIInChI=1S/C15H18N4S/c1-10-8-11-6-4-5-7-12(11)19(10)14-9-13(16-2)17-15(18-14)20-3/h4-7,9-10H,8H2,1-3H3,(H,16,17,18)
InChIKeyPDRLYQQHJZSGFH-UHFFFAOYSA-N
XLogP3.32
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-methylsulfanylpyrimidin-4-yl]hydrazine
CID 80909047
N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine
CID 80755891
6-(1,3-dihydroisoindol-2-yl)-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 80822675
N-methyl-6-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-methylsulfanylpyrimidin-4-amine
CID 80818766
[6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]hydrazine
CID 80916971
N-(2,4-difluorophenyl)-2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-amine
CID 112879061
1-(6-chloro-2-ethylpyrimidin-4-yl)-2-methyl-2,3-dihydroindole
CID 80943520
4-[[2-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]amino]benzoic acid
CID 113193343
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
N-(2,6-difluorophenyl)-4-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)pyrimidin-2-amine
CID 112932172
(2R)-2-methyl-1-(6-methyl-2-methylsulfanylpyrimidin-4-yl)-2,3-dihydroindole-5-carboxylic acid
CID 100802392

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine?
The IUPAC name of N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine (CID 80753740) is N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine.
What is the SMILES notation for N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine?
The canonical SMILES for N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine is CNc1cc(N2c3ccccc3CC2C)nc(SC)n1.
What is the InChIKey of N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine?
The InChIKey is PDRLYQQHJZSGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4S/c1-10-8-11-6-4-5-7-12(11)19(10)14-9-13(16-2)17-15(18-14)20-3/h4-7,9-10H,8H2,1-3H3,(H,16,17,18).
What are the key properties of N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine?
N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine has a molecular weight of 286.40 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(2-methyl-2,3-dihydroindol-1-yl)-2-methylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 80753740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).