2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine

C14H23N3O2 — CID 110104945

IUPAC2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine
SMILESCc1cnc(C2CN(CC3CCOCC3)CCO2)[nH]1
InChIInChI=1S/C14H23N3O2/c1-11-8-15-14(16-11)13-10-17(4-7-19-13)9-12-2-5-18-6-3-12/h8,12-13H,2-7,9-10H2,1H3,(H,15,16)
InChIKeyJDUQLRVLVRGEAP-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.52
Rot. Bonds3

About 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine

2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine (PubChem CID 110104945) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine.

Molecular Properties

Compound Name2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine
PubChem CID110104945
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine
SMILESCc1cnc(C2CN(CC3CCOCC3)CCO2)[nH]1
InChIInChI=1S/C14H23N3O2/c1-11-8-15-14(16-11)13-10-17(4-7-19-13)9-12-2-5-18-6-3-12/h8,12-13H,2-7,9-10H2,1H3,(H,15,16)
InChIKeyJDUQLRVLVRGEAP-UHFFFAOYSA-N
XLogP1.52
TPSA50.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-morpholin-4-ylethanone
CID 124953608
(2R)-4-(1H-imidazol-5-ylmethyl)-2-(5-methyl-1H-imidazol-2-yl)morpholine
CID 125017640
1-[2-[4-(cyclohexylmethyl)morpholin-2-yl]-1H-imidazol-5-yl]-N,N-dimethylmethanamine
CID 110117065
2-(5-methyl-1H-imidazol-2-yl)-4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 110104978
(2S)-4-(1-ethylpiperidin-4-yl)-2-(5-methyl-1H-imidazol-2-yl)morpholine
CID 125012121
(2R)-2-(5-methyl-1H-imidazol-2-yl)-4-(3-phenylpropyl)morpholine
CID 124987098
2-cyclopropyl-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 73439823
(2S)-4-[(2,5-difluorophenyl)methyl]-2-(5-methyl-1H-imidazol-2-yl)morpholine
CID 124963019
(2R)-2-(5-methyl-1H-imidazol-2-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
CID 124960812
(2S)-2-(5-methyl-1H-imidazol-2-yl)-4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]morpholine
CID 124960811
(2R)-4-(cyclohexylmethyl)-2-(5-methylpyrazin-2-yl)morpholine
CID 124965040
3-[[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]methyl]benzoic acid
CID 124969004

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine?
The IUPAC name of 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine (CID 110104945) is 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine.
What is the SMILES notation for 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine?
The canonical SMILES for 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine is Cc1cnc(C2CN(CC3CCOCC3)CCO2)[nH]1.
What is the InChIKey of 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine?
The InChIKey is JDUQLRVLVRGEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-11-8-15-14(16-11)13-10-17(4-7-19-13)9-12-2-5-18-6-3-12/h8,12-13H,2-7,9-10H2,1H3,(H,15,16).
What are the key properties of 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine?
2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine has a molecular weight of 265.36 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1H-imidazol-2-yl)-4-(oxan-4-ylmethyl)morpholine is sourced from PubChem (CID 110104945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).