5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine

C11H18BrN3O — CID 79196793

IUPAC5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine
SMILESCCNc1nc(C(C)(C)OC)nc(C)c1Br
InChIInChI=1S/C11H18BrN3O/c1-6-13-9-8(12)7(2)14-10(15-9)11(3,4)16-5/h6H2,1-5H3,(H,13,14,15)
InChIKeyZJSRCVJSFPKDPL-UHFFFAOYSA-N
MW288.19 g/mol
LogP2.86
Rot. Bonds4

About 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine

5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine (PubChem CID 79196793) has the molecular formula C11H18BrN3O and a molecular weight of 288.19 g/mol. Its IUPAC name is 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine
PubChem CID79196793
Molecular FormulaC11H18BrN3O
Molecular Weight288.19 g/mol
Exact Mass287.06
IUPAC Name5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine
SMILESCCNc1nc(C(C)(C)OC)nc(C)c1Br
InChIInChI=1S/C11H18BrN3O/c1-6-13-9-8(12)7(2)14-10(15-9)11(3,4)16-5/h6H2,1-5H3,(H,13,14,15)
InChIKeyZJSRCVJSFPKDPL-UHFFFAOYSA-N
XLogP2.86
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.19
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-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-bromo-2-(3-ethoxypentan-3-yl)-N-ethyl-6-methylpyrimidin-4-amine
CID 116776495
5-bromo-2-(2-ethoxypropan-2-yl)-N,6-dimethylpyrimidin-4-amine
CID 116729311
5-bromo-2,6-ditert-butyl-N-ethylpyrimidin-4-amine
CID 66307012
5-ethyl-2-(2-methoxypropan-2-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 79197133
1-[2-(2-methoxypropan-2-yl)-4,6-dimethylpyrimidin-5-yl]-N-methylmethanamine
CID 79197493
5-bromo-6-cyclopropyl-N-ethyl-2-(2-methoxybutan-2-yl)pyrimidin-4-amine
CID 116777186
5-bromo-N-ethyl-2-[4-(methoxymethyl)phenyl]-6-methylpyrimidin-4-amine
CID 66295720
N-ethyl-2-(2-methoxypropan-2-yl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472464
5-bromo-2-(3-ethoxypentan-3-yl)-N,6-dimethylpyrimidin-4-amine
CID 116776475
5-bromo-N-ethyl-2-[2-(methoxymethyl)phenyl]-6-methylpyrimidin-4-amine
CID 66297841
N-[[2-(2-methoxypropan-2-yl)-4,6-dimethylpyrimidin-5-yl]methyl]-2-methylpropan-2-amine
CID 79197963
5-bromo-2-(2,5-dimethoxyphenyl)-N-ethyl-6-methylpyrimidin-4-amine
CID 66302187

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine?
The IUPAC name of 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine (CID 79196793) is 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine is CCNc1nc(C(C)(C)OC)nc(C)c1Br.
What is the InChIKey of 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine?
The InChIKey is ZJSRCVJSFPKDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrN3O/c1-6-13-9-8(12)7(2)14-10(15-9)11(3,4)16-5/h6H2,1-5H3,(H,13,14,15).
What are the key properties of 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine?
5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine has a molecular weight of 288.19 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-ethyl-2-(2-methoxypropan-2-yl)-6-methylpyrimidin-4-amine is sourced from PubChem (CID 79196793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).