2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol

C15H15N3O — CID 105113593

IUPAC2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol
SMILESCn1ccnc1CC(O)c1cccc2ncccc12
InChIInChI=1S/C15H15N3O/c1-18-9-8-17-15(18)10-14(19)12-4-2-6-13-11(12)5-3-7-16-13/h2-9,14,19H,10H2,1H3
InChIKeyLSITWSZDLQGCBW-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.24
Rot. Bonds3

About 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol

2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol (PubChem CID 105113593) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol.

Molecular Properties

Compound Name2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol
PubChem CID105113593
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol
SMILESCn1ccnc1CC(O)c1cccc2ncccc12
InChIInChI=1S/C15H15N3O/c1-18-9-8-17-15(18)10-14(19)12-4-2-6-13-11(12)5-3-7-16-13/h2-9,14,19H,10H2,1H3
InChIKeyLSITWSZDLQGCBW-UHFFFAOYSA-N
XLogP2.24
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol
CID 105112369
2-(1-methylimidazol-2-yl)-1-quinolin-8-ylethanol
CID 79744882
2-(2-methyl-1,2,4-triazol-3-yl)-1-quinolin-5-ylethanol
CID 105107161
2-(2-ethyl-1,2,4-triazol-3-yl)-1-quinolin-5-ylethanol
CID 105109180
2-(1-methylimidazol-2-yl)-1-quinolin-4-ylethanamine
CID 105167218
1-(2-ethylphenyl)-2-(1-methylimidazol-2-yl)ethanol
CID 79744422
1-(1-benzothiophen-3-yl)-2-(1-methylimidazol-2-yl)ethanol
CID 79744320
2-(3-chlorophenyl)-1-quinolin-5-ylethanol
CID 81220656
(1R)-1-quinolin-5-ylethanol
CID 86326294
3-methoxy-1-quinolin-5-ylpropan-1-ol
CID 81220357
2-(1-methylimidazol-2-yl)-1-thiophen-2-ylethanol
CID 79745049
3-methoxy-3-methyl-1-quinolin-5-ylbutan-1-ol
CID 103027648

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol?
The IUPAC name of 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol (CID 105113593) is 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol.
What is the SMILES notation for 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol?
The canonical SMILES for 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol is Cn1ccnc1CC(O)c1cccc2ncccc12.
What is the InChIKey of 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol?
The InChIKey is LSITWSZDLQGCBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-18-9-8-17-15(18)10-14(19)12-4-2-6-13-11(12)5-3-7-16-13/h2-9,14,19H,10H2,1H3.
What are the key properties of 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol?
2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol has a molecular weight of 253.31 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol is sourced from PubChem (CID 105113593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).