(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol

C11H16N4O — CID 66117982

IUPAC(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol
SMILESCCCn1ccnc1C(O)c1cncn1C
InChIInChI=1S/C11H16N4O/c1-3-5-15-6-4-13-11(15)10(16)9-7-12-8-14(9)2/h4,6-8,10,16H,3,5H2,1-2H3
InChIKeyJZWALCUCFIKZPH-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.11
Rot. Bonds4

About (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol

(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol (PubChem CID 66117982) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol.

Molecular Properties

Compound Name(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol
PubChem CID66117982
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol
SMILESCCCn1ccnc1C(O)c1cncn1C
InChIInChI=1S/C11H16N4O/c1-3-5-15-6-4-13-11(15)10(16)9-7-12-8-14(9)2/h4,6-8,10,16H,3,5H2,1-2H3
InChIKeyJZWALCUCFIKZPH-UHFFFAOYSA-N
XLogP1.11
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-cyclopropylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol
CID 66140856
2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol
CID 79744158
(1-propylimidazol-2-yl)-pyridin-3-ylmethanol
CID 61315543
1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 82903281
(1-propylimidazol-2-yl)-(1H-pyrazol-4-yl)methanol
CID 63080686
N-[(1-ethylimidazol-2-yl)-(3-methylimidazol-4-yl)methyl]ethanamine
CID 82903316
(3,5-dimethyl-2-pyridinyl)-(1-propylimidazol-2-yl)methanol
CID 113365536
(5-methylfuran-3-yl)-(1-propylimidazol-2-yl)methanol
CID 114822737
(5-methylfuran-2-yl)-(1-propylimidazol-2-yl)methanol
CID 61316298
(3-methylimidazol-4-yl)-(1-propylpyrazol-4-yl)methanol
CID 66118416
(3-tert-butyl-1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol
CID 83091359
(5-ethylfuran-2-yl)-(1-propylimidazol-2-yl)methanol
CID 63976677

Frequently Asked Questions

What is the IUPAC name of (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol?
The IUPAC name of (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol (CID 66117982) is (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol.
What is the SMILES notation for (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol?
The canonical SMILES for (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol is CCCn1ccnc1C(O)c1cncn1C.
What is the InChIKey of (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol?
The InChIKey is JZWALCUCFIKZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-3-5-15-6-4-13-11(15)10(16)9-7-12-8-14(9)2/h4,6-8,10,16H,3,5H2,1-2H3.
What are the key properties of (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol?
(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol has a molecular weight of 220.28 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol is sourced from PubChem (CID 66117982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).