3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol

C14H17N3O2 — CID 114720892

IUPAC3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol
SMILESCc1cc(O)ccc1-n1cncc1C1CNCCO1
InChIInChI=1S/C14H17N3O2/c1-10-6-11(18)2-3-12(10)17-9-16-7-13(17)14-8-15-4-5-19-14/h2-3,6-7,9,14-15,18H,4-5,8H2,1H3
InChIKeyFUZUWKQQOHBBNW-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.55
Rot. Bonds2

About 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol

3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol (PubChem CID 114720892) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol.

Molecular Properties

Compound Name3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol
PubChem CID114720892
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol
SMILESCc1cc(O)ccc1-n1cncc1C1CNCCO1
InChIInChI=1S/C14H17N3O2/c1-10-6-11(18)2-3-12(10)17-9-16-7-13(17)14-8-15-4-5-19-14/h2-3,6-7,9,14-15,18H,4-5,8H2,1H3
InChIKeyFUZUWKQQOHBBNW-UHFFFAOYSA-N
XLogP1.55
TPSA59.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-(4-bromo-3-methylphenyl)imidazol-4-yl]morpholine
CID 114716609
3-bromo-4-(5-morpholin-2-ylimidazol-1-yl)benzonitrile
CID 107795804
3-methyl-4-morpholin-2-ylphenol
CID 67032452
2-(3-pyridin-3-ylimidazol-4-yl)morpholine
CID 114717439
2-[3-(3,4-dimethoxyphenyl)imidazol-4-yl]morpholine
CID 114716528
2-[3-(3-bromo-5-methoxyphenyl)imidazol-4-yl]morpholine
CID 114721648
2-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]morpholine
CID 114958077
2-[3-(3-chloro-4-fluorophenyl)imidazol-4-yl]morpholine
CID 114717769
2-[3-(4-propan-2-yloxyphenyl)imidazol-4-yl]morpholine
CID 114717817
2-[3-(4-bromo-3-methoxyphenyl)imidazol-4-yl]morpholine
CID 114721626
2-(3-pentan-3-ylimidazol-4-yl)morpholine
CID 114717268
2-(3-butan-2-ylimidazol-4-yl)morpholine
CID 114717185

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol?
The IUPAC name of 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol (CID 114720892) is 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol.
What is the SMILES notation for 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol?
The canonical SMILES for 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol is Cc1cc(O)ccc1-n1cncc1C1CNCCO1.
What is the InChIKey of 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol?
The InChIKey is FUZUWKQQOHBBNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10-6-11(18)2-3-12(10)17-9-16-7-13(17)14-8-15-4-5-19-14/h2-3,6-7,9,14-15,18H,4-5,8H2,1H3.
What are the key properties of 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol?
3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol has a molecular weight of 259.31 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(5-morpholin-2-ylimidazol-1-yl)phenol is sourced from PubChem (CID 114720892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).