5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine

C14H15Br2N3 — CID 103083787

IUPAC5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine
SMILESCCCc1nc(-c2ccc(Br)cc2C)nc(N)c1Br
InChIInChI=1S/C14H15Br2N3/c1-3-4-11-12(16)13(17)19-14(18-11)10-6-5-9(15)7-8(10)2/h5-7H,3-4H2,1-2H3,(H2,17,18,19)
InChIKeyHMCOIFIRYGNIMN-UHFFFAOYSA-N
MW385.10 g/mol
LogP4.51
Rot. Bonds3

About 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine

5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine (PubChem CID 103083787) has the molecular formula C14H15Br2N3 and a molecular weight of 385.10 g/mol. Its IUPAC name is 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine
PubChem CID103083787
Molecular FormulaC14H15Br2N3
Molecular Weight385.10 g/mol
Exact Mass382.96
IUPAC Name5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine
SMILESCCCc1nc(-c2ccc(Br)cc2C)nc(N)c1Br
InChIInChI=1S/C14H15Br2N3/c1-3-4-11-12(16)13(17)19-14(18-11)10-6-5-9(15)7-8(10)2/h5-7H,3-4H2,1-2H3,(H2,17,18,19)
InChIKeyHMCOIFIRYGNIMN-UHFFFAOYSA-N
XLogP4.51
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.10
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromo-2-methylphenyl)-4,6-dichloro-5-propylpyrimidine
CID 103083580
5-bromo-2-(4-bromo-2-methylphenyl)-N,6-diethylpyrimidin-4-amine
CID 103083799
5-bromo-2-(5-bromothiophen-2-yl)-6-propylpyrimidin-4-amine
CID 66307530
2-(4-bromo-2-methylphenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 103083742
5-bromo-2-(2-methylpyrimidin-4-yl)-6-propylpyrimidin-4-amine
CID 115528480
5-bromo-2-(4-bromo-2-methylphenyl)-N-ethyl-6-methylpyrimidin-4-amine
CID 103083781
5-bromo-2-[2-(difluoromethoxy)phenyl]-6-propylpyrimidin-4-amine
CID 66295361
5-bromo-2-methyl-6-propylpyrimidin-4-amine
CID 66307126
5-iodo-2-(2-methylphenyl)-6-propylpyrimidin-4-amine
CID 66307571
3-(4-bromo-2-methylphenyl)-1,2,4-thiadiazol-5-amine
CID 103083523
5-bromo-6-propyl-2-quinolin-2-ylpyrimidin-4-amine
CID 66306932
2-(4-bromo-2-methylphenyl)-6-methyl-N-propylpyrimidin-4-amine
CID 103083738

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine (CID 103083787) is 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine is CCCc1nc(-c2ccc(Br)cc2C)nc(N)c1Br.
What is the InChIKey of 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine?
The InChIKey is HMCOIFIRYGNIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Br2N3/c1-3-4-11-12(16)13(17)19-14(18-11)10-6-5-9(15)7-8(10)2/h5-7H,3-4H2,1-2H3,(H2,17,18,19).
What are the key properties of 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine?
5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine has a molecular weight of 385.10 g/mol, XLogP of 4.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-amine is sourced from PubChem (CID 103083787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).