1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol

C13H17N3O — CID 63977142

IUPAC1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol
SMILESCCCn1ccnc1C(O)Cc1ccccn1
InChIInChI=1S/C13H17N3O/c1-2-8-16-9-7-15-13(16)12(17)10-11-5-3-4-6-14-11/h3-7,9,12,17H,2,8,10H2,1H3
InChIKeyWENLBUMZZCUENE-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.96
Rot. Bonds5

About 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol

1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol (PubChem CID 63977142) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol.

Molecular Properties

Compound Name1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol
PubChem CID63977142
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol
SMILESCCCn1ccnc1C(O)Cc1ccccn1
InChIInChI=1S/C13H17N3O/c1-2-8-16-9-7-15-13(16)12(17)10-11-5-3-4-6-14-11/h3-7,9,12,17H,2,8,10H2,1H3
InChIKeyWENLBUMZZCUENE-UHFFFAOYSA-N
XLogP1.96
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethylimidazol-2-yl)-2-pyridin-2-ylethanol
CID 63977321
1-(1-ethylimidazol-2-yl)-2-phenylethanol
CID 63976496
2-methyl-2-phenyl-1-(1-propylimidazol-2-yl)propan-1-ol
CID 63975212
N-propyl-1-(1-propylimidazol-2-yl)-3-pyridin-2-ylpropan-2-amine
CID 79752625
N-ethyl-1-(1-ethylimidazol-2-yl)-2-pyridin-2-ylethanamine
CID 63968337
3-propoxy-1-(1-propylimidazol-2-yl)propan-1-ol
CID 105098448
1-(4-chloro-1-propylpyrazol-5-yl)-2-pyridin-2-ylethanol
CID 114642988
2-phenyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 114029101
2-(2-bromophenyl)-1-(1-ethylimidazol-2-yl)ethanol
CID 63975016
2-(3-fluorophenyl)sulfanyl-1-(1-propylimidazol-2-yl)ethanol
CID 66070414
1,2-dipyridin-2-ylethanol
CID 11458306
(2-methoxy-3-pyridinyl)-(1-propylimidazol-2-yl)methanol
CID 55125650

Frequently Asked Questions

What is the IUPAC name of 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol?
The IUPAC name of 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol (CID 63977142) is 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol.
What is the SMILES notation for 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol?
The canonical SMILES for 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol is CCCn1ccnc1C(O)Cc1ccccn1.
What is the InChIKey of 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol?
The InChIKey is WENLBUMZZCUENE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-2-8-16-9-7-15-13(16)12(17)10-11-5-3-4-6-14-11/h3-7,9,12,17H,2,8,10H2,1H3.
What are the key properties of 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol?
1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol has a molecular weight of 231.30 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propylimidazol-2-yl)-2-pyridin-2-ylethanol is sourced from PubChem (CID 63977142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).