2-(3-pyridin-3-ylimidazol-4-yl)morpholine

C12H14N4O — CID 114717439

IUPAC2-(3-pyridin-3-ylimidazol-4-yl)morpholine
SMILESc1cncc(-n2cncc2C2CNCCO2)c1
InChIInChI=1S/C12H14N4O/c1-2-10(6-13-3-1)16-9-15-7-11(16)12-8-14-4-5-17-12/h1-3,6-7,9,12,14H,4-5,8H2
InChIKeyUFECGQZBZJUHHB-UHFFFAOYSA-N
MW230.27 g/mol
LogP0.93
Rot. Bonds2

About 2-(3-pyridin-3-ylimidazol-4-yl)morpholine

2-(3-pyridin-3-ylimidazol-4-yl)morpholine (PubChem CID 114717439) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-(3-pyridin-3-ylimidazol-4-yl)morpholine.

Molecular Properties

Compound Name2-(3-pyridin-3-ylimidazol-4-yl)morpholine
PubChem CID114717439
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name2-(3-pyridin-3-ylimidazol-4-yl)morpholine
SMILESc1cncc(-n2cncc2C2CNCCO2)c1
InChIInChI=1S/C12H14N4O/c1-2-10(6-13-3-1)16-9-15-7-11(16)12-8-14-4-5-17-12/h1-3,6-7,9,12,14H,4-5,8H2
InChIKeyUFECGQZBZJUHHB-UHFFFAOYSA-N
XLogP0.93
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-[6-(trifluoromethyl)-3-pyridinyl]imidazol-4-yl]morpholine
CID 114721560
2-[3-(1-pyridin-3-ylethyl)imidazol-4-yl]morpholine
CID 114717855
2-[3-(3,4-dimethoxyphenyl)imidazol-4-yl]morpholine
CID 114716528
2-[3-(4-bromo-3-methylphenyl)imidazol-4-yl]morpholine
CID 114716609
2-[3-(4-propan-2-yloxyphenyl)imidazol-4-yl]morpholine
CID 114717817
2-[3-(3-chloro-4-fluorophenyl)imidazol-4-yl]morpholine
CID 114717769
2-[3-(3-bromo-5-methoxyphenyl)imidazol-4-yl]morpholine
CID 114721648
2-[3-(4-bromo-3-methoxyphenyl)imidazol-4-yl]morpholine
CID 114721626
3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol
CID 114720892
2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine
CID 114958077
2-(3-pentan-3-ylimidazol-4-yl)morpholine
CID 114717268
3-bromo-4-(5-morpholin-2-ylimidazol-1-yl)benzonitrile
CID 107795804

Frequently Asked Questions

What is the IUPAC name of 2-(3-pyridin-3-ylimidazol-4-yl)morpholine?
The IUPAC name of 2-(3-pyridin-3-ylimidazol-4-yl)morpholine (CID 114717439) is 2-(3-pyridin-3-ylimidazol-4-yl)morpholine.
What is the SMILES notation for 2-(3-pyridin-3-ylimidazol-4-yl)morpholine?
The canonical SMILES for 2-(3-pyridin-3-ylimidazol-4-yl)morpholine is c1cncc(-n2cncc2C2CNCCO2)c1.
What is the InChIKey of 2-(3-pyridin-3-ylimidazol-4-yl)morpholine?
The InChIKey is UFECGQZBZJUHHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-2-10(6-13-3-1)16-9-15-7-11(16)12-8-14-4-5-17-12/h1-3,6-7,9,12,14H,4-5,8H2.
What are the key properties of 2-(3-pyridin-3-ylimidazol-4-yl)morpholine?
2-(3-pyridin-3-ylimidazol-4-yl)morpholine has a molecular weight of 230.27 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-pyridin-3-ylimidazol-4-yl)morpholine is sourced from PubChem (CID 114717439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).