6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine

C9H11ClIN3O — CID 162736276

IUPAC6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine
SMILESNc1cc(Cl)nc(N2CCOCC2)c1I
InChIInChI=1S/C9H11ClIN3O/c10-7-5-6(12)8(11)9(13-7)14-1-3-15-4-2-14/h5H,1-4H2,(H2,12,13)
InChIKeyQXVOYKYCAWIQAH-UHFFFAOYSA-N
MW339.56 g/mol
LogP1.76
Rot. Bonds1

About 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine

6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine (PubChem CID 162736276) has the molecular formula C9H11ClIN3O and a molecular weight of 339.56 g/mol. Its IUPAC name is 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine.

Molecular Properties

Compound Name6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine
PubChem CID162736276
Molecular FormulaC9H11ClIN3O
Molecular Weight339.56 g/mol
Exact Mass338.96
IUPAC Name6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine
SMILESNc1cc(Cl)nc(N2CCOCC2)c1I
InChIInChI=1S/C9H11ClIN3O/c10-7-5-6(12)8(11)9(13-7)14-1-3-15-4-2-14/h5H,1-4H2,(H2,12,13)
InChIKeyQXVOYKYCAWIQAH-UHFFFAOYSA-N
XLogP1.76
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.56
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

4-(6-chloro-3-iodopyrazin-2-yl)morpholine
CID 165356549
5-chloro-2-morpholin-4-ylpyridin-3-amine
CID 80503744
4-(2,6-dichloro-4-pyridinyl)morpholine;2,4,6-trichloropyridine
CID 159726941
5-chloro-6-morpholin-4-ylpyridin-3-amine;hydron
CID 69345402
2-morpholin-4-ylpyridine-3,5-diamine
CID 21082858
2-chloro-5-morpholin-4-ylpyridin-3-amine
CID 59631039
4,6-dimorpholin-4-ylpyrimidin-5-amine
CID 19137612
4-(2-chloro-6-iodo-5-methylpyrrolo[3,2-d]pyrimidin-4-yl)morpholine
CID 166155958
1-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)cyclopropan-1-amine
CID 121428505
4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine
CID 86624262
6-chloro-2-N-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
CID 121468961
(2-chloro-4-morpholin-4-ylthieno[3,2-c]pyridin-6-yl)methanamine
CID 69090067

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine?
The IUPAC name of 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine (CID 162736276) is 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine.
What is the SMILES notation for 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine?
The canonical SMILES for 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine is Nc1cc(Cl)nc(N2CCOCC2)c1I.
What is the InChIKey of 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine?
The InChIKey is QXVOYKYCAWIQAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClIN3O/c10-7-5-6(12)8(11)9(13-7)14-1-3-15-4-2-14/h5H,1-4H2,(H2,12,13).
What are the key properties of 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine?
6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine has a molecular weight of 339.56 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-iodo-2-morpholin-4-ylpyridin-4-amine is sourced from PubChem (CID 162736276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).