5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine

C11H18BrN3 — CID 66307676

IUPAC5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine
SMILESCCCNc1nc(CCC)nc(C)c1Br
InChIInChI=1S/C11H18BrN3/c1-4-6-9-14-8(3)10(12)11(15-9)13-7-5-2/h4-7H2,1-3H3,(H,13,14,15)
InChIKeyFNYGKBYANXTMBL-UHFFFAOYSA-N
MW272.19 g/mol
LogP3.32
Rot. Bonds5

About 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine

5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine (PubChem CID 66307676) has the molecular formula C11H18BrN3 and a molecular weight of 272.19 g/mol. Its IUPAC name is 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine
PubChem CID66307676
Molecular FormulaC11H18BrN3
Molecular Weight272.19 g/mol
Exact Mass271.07
IUPAC Name5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine
SMILESCCCNc1nc(CCC)nc(C)c1Br
InChIInChI=1S/C11H18BrN3/c1-4-6-9-14-8(3)10(12)11(15-9)13-7-5-2/h4-7H2,1-3H3,(H,13,14,15)
InChIKeyFNYGKBYANXTMBL-UHFFFAOYSA-N
XLogP3.32
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.19
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-(methoxymethyl)-6-methyl-N-propylpyrimidin-4-amine
CID 66306879
5-bromo-2,6-dimethyl-N-propylpyrimidin-4-amine
CID 66304687
5-bromo-2-[2-(2,2-difluoroethoxy)ethyl]-6-methyl-N-propylpyrimidin-4-amine
CID 103150375
5-bromo-2-(2-methoxypropyl)-6-methyl-N-propylpyrimidin-4-amine
CID 113391676
5-bromo-2-[(2-fluorophenyl)methyl]-6-methyl-N-propylpyrimidin-4-amine
CID 66307477
5-bromo-6-methyl-N-propyl-2-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 66304693
5-bromo-N,6-dipropyl-2-(propylsulfanylmethyl)pyrimidin-4-amine
CID 66305569
5-bromo-4-chloro-6-methyl-2-propylpyrimidine
CID 66293537
5-bromo-6-tert-butyl-2-(2-ethoxyethyl)-N-propylpyrimidin-4-amine
CID 106815296
4-N-[2-(dimethylamino)ethyl]-5-methyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80980867
5-bromo-2-(1-ethoxypropyl)-6-methyl-N-propylpyrimidin-4-amine
CID 116729325
2,5-diethyl-6-methyl-N-propylpyrimidin-4-amine
CID 62191968

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine?
The IUPAC name of 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine (CID 66307676) is 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine is CCCNc1nc(CCC)nc(C)c1Br.
What is the InChIKey of 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine?
The InChIKey is FNYGKBYANXTMBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrN3/c1-4-6-9-14-8(3)10(12)11(15-9)13-7-5-2/h4-7H2,1-3H3,(H,13,14,15).
What are the key properties of 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine?
5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine has a molecular weight of 272.19 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methyl-N,2-dipropylpyrimidin-4-amine is sourced from PubChem (CID 66307676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).