4-(1H-imidazol-2-yl)morpholine

C7H11N3O — CID 22918961

IUPAC4-(1H-imidazol-2-yl)morpholine
SMILESc1c[nH]c(N2CCOCC2)n1
InChIInChI=1S/C7H11N3O/c1-2-9-7(8-1)10-3-5-11-6-4-10/h1-2H,3-6H2,(H,8,9)
InChIKeyNAROVGXVMKGQLH-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.25
Rot. Bonds1

About 4-(1H-imidazol-2-yl)morpholine

4-(1H-imidazol-2-yl)morpholine (PubChem CID 22918961) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 4-(1H-imidazol-2-yl)morpholine.

Molecular Properties

Compound Name4-(1H-imidazol-2-yl)morpholine
PubChem CID22918961
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name4-(1H-imidazol-2-yl)morpholine
SMILESc1c[nH]c(N2CCOCC2)n1
InChIInChI=1S/C7H11N3O/c1-2-9-7(8-1)10-3-5-11-6-4-10/h1-2H,3-6H2,(H,8,9)
InChIKeyNAROVGXVMKGQLH-UHFFFAOYSA-N
XLogP0.25
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1H-imidazol-2-yl)morpholine?
The IUPAC name of 4-(1H-imidazol-2-yl)morpholine (CID 22918961) is 4-(1H-imidazol-2-yl)morpholine.
What is the SMILES notation for 4-(1H-imidazol-2-yl)morpholine?
The canonical SMILES for 4-(1H-imidazol-2-yl)morpholine is c1c[nH]c(N2CCOCC2)n1.
What is the InChIKey of 4-(1H-imidazol-2-yl)morpholine?
The InChIKey is NAROVGXVMKGQLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-2-9-7(8-1)10-3-5-11-6-4-10/h1-2H,3-6H2,(H,8,9).
What are the key properties of 4-(1H-imidazol-2-yl)morpholine?
4-(1H-imidazol-2-yl)morpholine has a molecular weight of 153.19 g/mol, XLogP of 0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-imidazol-2-yl)morpholine is sourced from PubChem (CID 22918961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).