5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine

C10H10BrN3O — CID 66297025

IUPAC5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
SMILESCNc1nc(-c2ccc(C)o2)ncc1Br
InChIInChI=1S/C10H10BrN3O/c1-6-3-4-8(15-6)10-13-5-7(11)9(12-2)14-10/h3-5H,1-2H3,(H,12,13,14)
InChIKeyYLNNKCFMXCNKGV-UHFFFAOYSA-N
MW268.11 g/mol
LogP2.85
Rot. Bonds2

About 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine

5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine (PubChem CID 66297025) has the molecular formula C10H10BrN3O and a molecular weight of 268.11 g/mol. Its IUPAC name is 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
PubChem CID66297025
Molecular FormulaC10H10BrN3O
Molecular Weight268.11 g/mol
Exact Mass267.00
IUPAC Name5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
SMILESCNc1nc(-c2ccc(C)o2)ncc1Br
InChIInChI=1S/C10H10BrN3O/c1-6-3-4-8(15-6)10-13-5-7(11)9(12-2)14-10/h3-5H,1-2H3,(H,12,13,14)
InChIKeyYLNNKCFMXCNKGV-UHFFFAOYSA-N
XLogP2.85
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.11
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(methylamino)-2-(5-methylfuran-2-yl)pyrimidine-5-carboxylic acid
CID 116864985
5-bromo-N-methyl-2-(6-methyl-3-pyridinyl)pyrimidin-4-amine
CID 104823414
5-bromo-N-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-amine
CID 66295477
5-fluoro-N,6-dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
CID 66000214
5-bromo-2-(3,4-dibromophenyl)-N-methylpyrimidin-4-amine
CID 114077544
N,6-dimethyl-2-(5-methylfuran-2-yl)-5-propan-2-ylpyrimidin-4-amine
CID 62914017
5-bromo-2-[4-(dimethylamino)phenyl]-N-methylpyrimidin-4-amine
CID 66296832
5-bromo-2-(2-chlorophenyl)-N-methylpyrimidin-4-amine
CID 66301431
5-bromo-2-(6-methoxynaphthalen-2-yl)-N-methylpyrimidin-4-amine
CID 66295670
5-bromo-N-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 66297991
5-bromo-N-methyl-2-(1H-1,2,4-triazol-5-yl)pyrimidin-4-amine
CID 66304283
[5,6-dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4-yl]hydrazine
CID 62250569

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine (CID 66297025) is 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine is CNc1nc(-c2ccc(C)o2)ncc1Br.
What is the InChIKey of 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine?
The InChIKey is YLNNKCFMXCNKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3O/c1-6-3-4-8(15-6)10-13-5-7(11)9(12-2)14-10/h3-5H,1-2H3,(H,12,13,14).
What are the key properties of 5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine?
5-bromo-N-methyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine has a molecular weight of 268.11 g/mol, XLogP of 2.85, 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-(5-methylfuran-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 66297025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).