1-(3-methylphenyl)-2-quinolin-7-yloxyethanol

C18H17NO2 — CID 107314538

IUPAC1-(3-methylphenyl)-2-quinolin-7-yloxyethanol
SMILESCc1cccc(C(O)COc2ccc3cccnc3c2)c1
InChIInChI=1S/C18H17NO2/c1-13-4-2-5-15(10-13)18(20)12-21-16-8-7-14-6-3-9-19-17(14)11-16/h2-11,18,20H,12H2,1H3
InChIKeyLVVXNMKDONYNCO-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.66
Rot. Bonds4

About 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol

1-(3-methylphenyl)-2-quinolin-7-yloxyethanol (PubChem CID 107314538) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol.

Molecular Properties

Compound Name1-(3-methylphenyl)-2-quinolin-7-yloxyethanol
PubChem CID107314538
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name1-(3-methylphenyl)-2-quinolin-7-yloxyethanol
SMILESCc1cccc(C(O)COc2ccc3cccnc3c2)c1
InChIInChI=1S/C18H17NO2/c1-13-4-2-5-15(10-13)18(20)12-21-16-8-7-14-6-3-9-19-17(14)11-16/h2-11,18,20H,12H2,1H3
InChIKeyLVVXNMKDONYNCO-UHFFFAOYSA-N
XLogP3.66
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-(2,2-diethoxyethoxy)quinoline
CID 107314200
2-phenoxy-1-quinolin-6-ylethanol
CID 81220739
2-(methylamino)-3-quinolin-7-yloxypropanoic acid
CID 107314757
1-(3-bromophenyl)-2-quinazolin-7-yloxyethanol
CID 167985590
(1R)-2-(3-methylphenoxy)-1-pyridin-2-ylethanol
CID 129362885
2-(quinolin-7-yloxymethyl)butane-1-sulfonamide
CID 107315542
3-[1-hydroxy-2-(4-methylphenoxy)ethyl]phenol
CID 117242770
3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-ol
CID 105118985
1-cyclopentyl-2-quinolin-7-yloxyethanamine
CID 107313426
7-[(2R)-1-methoxypropan-2-yl]oxyquinoline
CID 141434593
3-amino-1-quinolin-7-ylpropan-1-ol
CID 84670752
3-quinolin-7-yloxypropanal
CID 107314214

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol?
The IUPAC name of 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol (CID 107314538) is 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol.
What is the SMILES notation for 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol?
The canonical SMILES for 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol is Cc1cccc(C(O)COc2ccc3cccnc3c2)c1.
What is the InChIKey of 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol?
The InChIKey is LVVXNMKDONYNCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-13-4-2-5-15(10-13)18(20)12-21-16-8-7-14-6-3-9-19-17(14)11-16/h2-11,18,20H,12H2,1H3.
What are the key properties of 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol?
1-(3-methylphenyl)-2-quinolin-7-yloxyethanol has a molecular weight of 279.34 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)-2-quinolin-7-yloxyethanol is sourced from PubChem (CID 107314538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).