(3-ethoxyphenyl)-quinolin-3-ylmethanol

C18H17NO2 — CID 60924190

IUPAC(3-ethoxyphenyl)-quinolin-3-ylmethanol
SMILESCCOc1cccc(C(O)c2cnc3ccccc3c2)c1
InChIInChI=1S/C18H17NO2/c1-2-21-16-8-5-7-14(11-16)18(20)15-10-13-6-3-4-9-17(13)19-12-15/h3-12,18,20H,2H2,1H3
InChIKeyBPRKUYCBXGUKBW-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.72
Rot. Bonds4

About (3-ethoxyphenyl)-quinolin-3-ylmethanol

(3-ethoxyphenyl)-quinolin-3-ylmethanol (PubChem CID 60924190) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is (3-ethoxyphenyl)-quinolin-3-ylmethanol.

Molecular Properties

Compound Name(3-ethoxyphenyl)-quinolin-3-ylmethanol
PubChem CID60924190
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name(3-ethoxyphenyl)-quinolin-3-ylmethanol
SMILESCCOc1cccc(C(O)c2cnc3ccccc3c2)c1
InChIInChI=1S/C18H17NO2/c1-2-21-16-8-5-7-14(11-16)18(20)15-10-13-6-3-4-9-17(13)19-12-15/h3-12,18,20H,2H2,1H3
InChIKeyBPRKUYCBXGUKBW-UHFFFAOYSA-N
XLogP3.72
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 ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methoxyphenyl)-quinolin-3-ylmethanol
CID 60924189
(4-ethoxyphenyl)-quinolin-3-ylmethanol
CID 63893046
(2-ethoxyphenyl)-quinolin-3-ylmethanol
CID 63893818
(4-methylphenyl)-quinolin-3-ylmethanol
CID 60924632
(3-ethoxyphenyl)-quinoxalin-5-ylmethanol
CID 105119584
chloro-(3-ethoxyphenyl)methanol
CID 141156919
(3-ethoxyphenyl)-pyrazin-2-ylmethanol
CID 63969423
1-quinolin-3-ylbutan-1-ol
CID 60924193
(4-chlorophenyl)-quinolin-3-ylmethanol
CID 20794845
(3-ethoxyphenyl)-(furan-3-yl)methanol
CID 63948949
(3-ethoxyphenyl)-[3-(2-methylpropyl)phenyl]methanol
CID 116542374
4-ethoxy-1-quinolin-3-ylbutan-1-ol
CID 105079383

Frequently Asked Questions

What is the IUPAC name of (3-ethoxyphenyl)-quinolin-3-ylmethanol?
The IUPAC name of (3-ethoxyphenyl)-quinolin-3-ylmethanol (CID 60924190) is (3-ethoxyphenyl)-quinolin-3-ylmethanol.
What is the SMILES notation for (3-ethoxyphenyl)-quinolin-3-ylmethanol?
The canonical SMILES for (3-ethoxyphenyl)-quinolin-3-ylmethanol is CCOc1cccc(C(O)c2cnc3ccccc3c2)c1.
What is the InChIKey of (3-ethoxyphenyl)-quinolin-3-ylmethanol?
The InChIKey is BPRKUYCBXGUKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-2-21-16-8-5-7-14(11-16)18(20)15-10-13-6-3-4-9-17(13)19-12-15/h3-12,18,20H,2H2,1H3.
What are the key properties of (3-ethoxyphenyl)-quinolin-3-ylmethanol?
(3-ethoxyphenyl)-quinolin-3-ylmethanol has a molecular weight of 279.34 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxyphenyl)-quinolin-3-ylmethanol is sourced from PubChem (CID 60924190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).