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

C11H17BrN4O — CID 79657263

IUPAC5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCCN1CCOC(c2ncc(Br)c(N)n2)C1
InChIInChI=1S/C11H17BrN4O/c1-2-3-16-4-5-17-9(7-16)11-14-6-8(12)10(13)15-11/h6,9H,2-5,7H2,1H3,(H2,13,14,15)
InChIKeySCDDXALFKXWQSM-UHFFFAOYSA-N
MW301.19 g/mol
LogP1.60
Rot. Bonds3

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

5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine (PubChem CID 79657263) has the molecular formula C11H17BrN4O and a molecular weight of 301.19 g/mol. Its IUPAC name is 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
PubChem CID79657263
Molecular FormulaC11H17BrN4O
Molecular Weight301.19 g/mol
Exact Mass300.06
IUPAC Name5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCCN1CCOC(c2ncc(Br)c(N)n2)C1
InChIInChI=1S/C11H17BrN4O/c1-2-3-16-4-5-17-9(7-16)11-14-6-8(12)10(13)15-11/h6,9H,2-5,7H2,1H3,(H2,13,14,15)
InChIKeySCDDXALFKXWQSM-UHFFFAOYSA-N
XLogP1.60
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.19
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-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-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657186
5-bromo-6-ethyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657802
4-amino-2-(4-ethylmorpholin-2-yl)pyrimidine-5-carboxylic acid
CID 116640989
5-iodo-N-propyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657646
4-cyclopropyl-2-(4-propylmorpholin-2-yl)pyrimidine-5-carboxylic acid
CID 79664457
2-(4-propylmorpholin-2-yl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472072
4-propan-2-yl-2-(4-propylmorpholin-2-yl)pyrimidine-5-carboxylic acid
CID 79664456
2-(4-propylmorpholin-2-yl)-7,8-dihydro-6H-quinazolin-5-one
CID 79658032
2-(2-bromophenyl)-4-propylmorpholine
CID 82184644
5-bromo-N-ethyl-2-(4-methylmorpholin-2-yl)pyrimidin-4-amine
CID 79089179
2-[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]thiophen-3-amine
CID 79669288
[2-(4-propylmorpholin-2-yl)-1H-imidazol-5-yl]methanamine
CID 79657962

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine (CID 79657263) is 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine is CCCN1CCOC(c2ncc(Br)c(N)n2)C1.
What is the InChIKey of 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The InChIKey is SCDDXALFKXWQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN4O/c1-2-3-16-4-5-17-9(7-16)11-14-6-8(12)10(13)15-11/h6,9H,2-5,7H2,1H3,(H2,13,14,15).
What are the key properties of 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine has a molecular weight of 301.19 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 79657263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).