2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine

C15H26N4O — CID 107165712

IUPAC2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine
SMILESCN1CCC(C)(Cn2cncc2C2CNCCO2)CC1
InChIInChI=1S/C15H26N4O/c1-15(3-6-18(2)7-4-15)11-19-12-17-9-13(19)14-10-16-5-8-20-14/h9,12,14,16H,3-8,10-11H2,1-2H3
InChIKeyZTAQIEHRSAJELO-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.28
Rot. Bonds3

About 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine

2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine (PubChem CID 107165712) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine.

Molecular Properties

Compound Name2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine
PubChem CID107165712
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine
SMILESCN1CCC(C)(Cn2cncc2C2CNCCO2)CC1
InChIInChI=1S/C15H26N4O/c1-15(3-6-18(2)7-4-15)11-19-12-17-9-13(19)14-10-16-5-8-20-14/h9,12,14,16H,3-8,10-11H2,1-2H3
InChIKeyZTAQIEHRSAJELO-UHFFFAOYSA-N
XLogP1.28
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine?
The IUPAC name of 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine (CID 107165712) is 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine.
What is the SMILES notation for 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine?
The canonical SMILES for 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine is CN1CCC(C)(Cn2cncc2C2CNCCO2)CC1.
What is the InChIKey of 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine?
The InChIKey is ZTAQIEHRSAJELO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-15(3-6-18(2)7-4-15)11-19-12-17-9-13(19)14-10-16-5-8-20-14/h9,12,14,16H,3-8,10-11H2,1-2H3.
What are the key properties of 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine?
2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine has a molecular weight of 278.40 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(1,4-dimethylpiperidin-4-yl)methyl]imidazol-4-yl]morpholine is sourced from PubChem (CID 107165712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).