5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine

C11H11BrN4 — CID 104823414

IUPAC5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
SMILESCNc1nc(-c2ccc(C)nc2)ncc1Br
InChIInChI=1S/C11H11BrN4/c1-7-3-4-8(5-14-7)10-15-6-9(12)11(13-2)16-10/h3-6H,1-2H3,(H,13,15,16)
InChIKeyADYHBBRTQTUTJB-UHFFFAOYSA-N
MW279.14 g/mol
LogP2.65
Rot. Bonds2

About 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine

5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine (PubChem CID 104823414) has the molecular formula C11H11BrN4 and a molecular weight of 279.14 g/mol. Its IUPAC name is 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
PubChem CID104823414
Molecular FormulaC11H11BrN4
Molecular Weight279.14 g/mol
Exact Mass278.02
IUPAC Name5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
SMILESCNc1nc(-c2ccc(C)nc2)ncc1Br
InChIInChI=1S/C11H11BrN4/c1-7-3-4-8(5-14-7)10-15-6-9(12)11(13-2)16-10/h3-6H,1-2H3,(H,13,15,16)
InChIKeyADYHBBRTQTUTJB-UHFFFAOYSA-N
XLogP2.65
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.14
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-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

5-iodo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
CID 104823417
5-bromo-2-(3,4-dibromophenyl)-N-methylpyrimidin-4-amine
CID 114077544
5-bromo-2-[4-(dimethylamino)phenyl]-N-methylpyrimidin-4-amine
CID 66296832
N,5,6-trimethyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
CID 104823338
5-bromo-N-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 66297991
5-bromo-2-(4-methoxy-3-methylphenyl)-N-methylpyrimidin-4-amine
CID 66296448
5-bromo-N-methyl-2-quinolin-6-ylpyrimidin-4-amine
CID 66304285
5-bromo-2-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-4-amine
CID 66295670
5-bromo-N-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-amine
CID 66295477
5-bromo-2-(3-chlorophenyl)-N-methylpyrimidin-4-amine
CID 66302245
5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
CID 66297025
5-bromo-N-methyl-2-(2-methylquinolin-4-yl)pyrimidin-4-amine
CID 79235763

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine (CID 104823414) is 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine is CNc1nc(-c2ccc(C)nc2)ncc1Br.
What is the InChIKey of 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine?
The InChIKey is ADYHBBRTQTUTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN4/c1-7-3-4-8(5-14-7)10-15-6-9(12)11(13-2)16-10/h3-6H,1-2H3,(H,13,15,16).
What are the key properties of 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine?
5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine has a molecular weight of 279.14 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine is sourced from PubChem (CID 104823414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).