6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine

C14H23IN4O — CID 79658035

IUPAC6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCCN1CCOC(c2nc(CC)c(I)c(NC)n2)C1
InChIInChI=1S/C14H23IN4O/c1-4-6-19-7-8-20-11(9-19)13-17-10(5-2)12(15)14(16-3)18-13/h11H,4-9H2,1-3H3,(H,16,17,18)
InChIKeyRGAXUHKUYNMYCP-UHFFFAOYSA-N
MW390.27 g/mol
LogP2.47
Rot. Bonds5

About 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine

6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine (PubChem CID 79658035) has the molecular formula C14H23IN4O and a molecular weight of 390.27 g/mol. Its IUPAC name is 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
PubChem CID79658035
Molecular FormulaC14H23IN4O
Molecular Weight390.27 g/mol
Exact Mass390.09
IUPAC Name6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
SMILESCCCN1CCOC(c2nc(CC)c(I)c(NC)n2)C1
InChIInChI=1S/C14H23IN4O/c1-4-6-19-7-8-20-11(9-19)13-17-10(5-2)12(15)14(16-3)18-13/h11H,4-9H2,1-3H3,(H,16,17,18)
InChIKeyRGAXUHKUYNMYCP-UHFFFAOYSA-N
XLogP2.47
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.27
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-5-iodo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657564
5-bromo-6-ethyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657802
N,6-dimethyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657800
1-[4,6-dimethyl-2-(4-propylmorpholin-2-yl)pyrimidin-5-yl]-N-methylmethanamine
CID 79657347
5-iodo-N-propyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657646
5-iodo-N-methyl-2-(oxolan-2-yl)-6-propylpyrimidin-4-amine
CID 66304985
5-bromo-6-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657186
6-ethyl-5-methyl-2-(4-methylmorpholin-2-yl)-N-propylpyrimidin-4-amine
CID 79089266
6-ethyl-5-iodo-N-methyl-2-(4-methylthiomorpholin-3-yl)pyrimidin-4-amine
CID 106445757
2-(4-propylmorpholin-2-yl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472072
[6-cyclopropyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-yl]hydrazine
CID 79657417
N-[[3-(4-propylmorpholin-2-yl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine
CID 79668683

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine (CID 79658035) is 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine is CCCN1CCOC(c2nc(CC)c(I)c(NC)n2)C1.
What is the InChIKey of 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
The InChIKey is RGAXUHKUYNMYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23IN4O/c1-4-6-19-7-8-20-11(9-19)13-17-10(5-2)12(15)14(16-3)18-13/h11H,4-9H2,1-3H3,(H,16,17,18).
What are the key properties of 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine?
6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine has a molecular weight of 390.27 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-iodo-N-methyl-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 79658035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).