5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine

C12H19BrN4O — CID 79657186

IUPAC5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCCN1CCOC(c2nc(C)c(Br)c(N)n2)C1
InChIInChI=1S/C12H19BrN4O/c1-3-4-17-5-6-18-9(7-17)12-15-8(2)10(13)11(14)16-12/h9H,3-7H2,1-2H3,(H2,14,15,16)
InChIKeyPFJSFVDIWGVXTR-UHFFFAOYSA-N
MW315.22 g/mol
LogP1.91
Rot. Bonds3

About 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine

5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine (PubChem CID 79657186) has the molecular formula C12H19BrN4O and a molecular weight of 315.22 g/mol. Its IUPAC name is 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
PubChem CID79657186
Molecular FormulaC12H19BrN4O
Molecular Weight315.22 g/mol
Exact Mass314.07
IUPAC Name5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCCN1CCOC(c2nc(C)c(Br)c(N)n2)C1
InChIInChI=1S/C12H19BrN4O/c1-3-4-17-5-6-18-9(7-17)12-15-8(2)10(13)11(14)16-12/h9H,3-7H2,1-2H3,(H2,14,15,16)
InChIKeyPFJSFVDIWGVXTR-UHFFFAOYSA-N
XLogP1.91
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.22
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-6-ethyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657802
5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657263
1-[4,6-dimethyl-2-(4-propylmorpholin-2-yl)pyrimidin-5-yl]-N-methylmethanamine
CID 79657347
2-(4-propylmorpholin-2-yl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472072
2-(5-bromo-4-chloro-6-cyclopropylpyrimidin-2-yl)-4-propylmorpholine
CID 79669077
N-ethyl-5-iodo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657564
6-methyl-2-(4-propylmorpholin-2-yl)pyrimidine-4-carbaldehyde
CID 79657111
N,6-dimethyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657800
5,6-dimethyl-2-(4-methylmorpholin-2-yl)pyrimidin-4-amine
CID 79088525
[2-(4-ethylmorpholin-2-yl)-4,6-dimethylpyrimidin-5-yl]methanamine
CID 79669278
[6-cyclopropyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-yl]hydrazine
CID 79657417
(1S)-1-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 104915391

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine (CID 79657186) is 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine is CCCN1CCOC(c2nc(C)c(Br)c(N)n2)C1.
What is the InChIKey of 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The InChIKey is PFJSFVDIWGVXTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19BrN4O/c1-3-4-17-5-6-18-9(7-17)12-15-8(2)10(13)11(14)16-12/h9H,3-7H2,1-2H3,(H2,14,15,16).
What are the key properties of 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine has a molecular weight of 315.22 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 79657186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).