2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine

C10H14IN3O — CID 104840022

IUPAC2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine
SMILESCCC1CN(c2ncc(I)cn2)CCO1
InChIInChI=1S/C10H14IN3O/c1-2-9-7-14(3-4-15-9)10-12-5-8(11)6-13-10/h5-6,9H,2-4,7H2,1H3
InChIKeyBXWUZMNHFQRNEY-UHFFFAOYSA-N
MW319.15 g/mol
LogP1.70
Rot. Bonds2

About 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine

2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine (PubChem CID 104840022) has the molecular formula C10H14IN3O and a molecular weight of 319.15 g/mol. Its IUPAC name is 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine
PubChem CID104840022
Molecular FormulaC10H14IN3O
Molecular Weight319.15 g/mol
Exact Mass319.02
IUPAC Name2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine
SMILESCCC1CN(c2ncc(I)cn2)CCO1
InChIInChI=1S/C10H14IN3O/c1-2-9-7-14(3-4-15-9)10-12-5-8(11)6-13-10/h5-6,9H,2-4,7H2,1H3
InChIKeyBXWUZMNHFQRNEY-UHFFFAOYSA-N
XLogP1.70
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.15
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-ethylmorpholin-4-yl)pyrimidin-5-amine
CID 61147387
2-(3-ethylpyrrolidin-1-yl)-5-iodopyrimidine
CID 104844112
2-[(2R)-2-(hydroxymethyl)morpholin-4-yl]pyrimidin-5-ol
CID 170608695
2-[2-(hydroxymethyl)morpholin-4-yl]pyrimidin-5-ol
CID 170608983
[4-(5-fluoropyrimidin-2-yl)morpholin-2-yl]methanol
CID 115750247
5-(2-ethylmorpholin-4-yl)pyrazin-2-amine
CID 80652381
[2-(2-ethylmorpholin-4-yl)-1,3-thiazol-5-yl]methanamine
CID 62751187
N-[(4-ethylmorpholin-2-yl)methyl]-5-iodopyrimidin-2-amine
CID 113459925
[4-[5-(2-methylpropyl)pyrimidin-2-yl]morpholin-2-yl]methanamine
CID 116976328
5-chloro-6-(2-ethylmorpholin-4-yl)pyrimidin-4-amine
CID 106811779
[6-(2-ethylmorpholin-4-yl)-3-pyridinyl]methanamine
CID 43562218
4-[5-(bromomethyl)-3-methyl-2-pyridinyl]-2-ethylmorpholine
CID 107080311

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine?
The IUPAC name of 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine (CID 104840022) is 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine.
What is the SMILES notation for 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine?
The canonical SMILES for 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine is CCC1CN(c2ncc(I)cn2)CCO1.
What is the InChIKey of 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine?
The InChIKey is BXWUZMNHFQRNEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14IN3O/c1-2-9-7-14(3-4-15-9)10-12-5-8(11)6-13-10/h5-6,9H,2-4,7H2,1H3.
What are the key properties of 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine?
2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine has a molecular weight of 319.15 g/mol, XLogP of 1.70, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-(5-iodopyrimidin-2-yl)morpholine is sourced from PubChem (CID 104840022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).