ethane;(6-methoxyquinolin-3-yl)methanol

C13H17NO2 — CID 174710700

IUPACethane;(6-methoxyquinolin-3-yl)methanol
SMILESCC.COc1ccc2ncc(CO)cc2c1
InChIInChI=1S/C11H11NO2.C2H6/c1-14-10-2-3-11-9(5-10)4-8(7-13)6-12-11;1-2/h2-6,13H,7H2,1H3;1-2H3
InChIKeyKMMINANZMCXXSR-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.76
Rot. Bonds2

About ethane;(6-methoxyquinolin-3-yl)methanol

ethane;(6-methoxyquinolin-3-yl)methanol (PubChem CID 174710700) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is ethane;(6-methoxyquinolin-3-yl)methanol.

Molecular Properties

Compound Nameethane;(6-methoxyquinolin-3-yl)methanol
PubChem CID174710700
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Nameethane;(6-methoxyquinolin-3-yl)methanol
SMILESCC.COc1ccc2ncc(CO)cc2c1
InChIInChI=1S/C11H11NO2.C2H6/c1-14-10-2-3-11-9(5-10)4-8(7-13)6-12-11;1-2/h2-6,13H,7H2,1H3;1-2H3
InChIKeyKMMINANZMCXXSR-UHFFFAOYSA-N
XLogP2.76
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl (2S)-2-amino-3-(6-methoxyquinolin-3-yl)propanoate
CID 18637046
3-ethyl-7-methoxyquinoline
CID 14361549
N-(2-hydroxyethyl)-6-methoxyquinoline-3-carboxamide
CID 110489941
methyl 3-(6-methoxyquinolin-3-yl)-3-oxopropanoate
CID 82665608
(4-methoxyphenyl)methanol
CID 7738
(7-methoxyisoquinolin-3-yl)methanol
CID 133056400
(6-methoxyquinolin-3-yl)-trimethylstannane;(7-methoxyquinolin-3-yl)-trimethylstannane
CID 67836027
(6-methoxyquinolin-3-yl)-phenylmethanone
CID 102416724
(6-methoxyquinolin-3-yl)carbamic acid
CID 22326813
2-(6-methoxyquinolin-3-yl)sulfanylacetaldehyde
CID 86662005
2-amino-2-(6-methoxyquinazolin-2-yl)propan-1-ol
CID 68603521
3-ethyl-6-(trifluoromethoxy)quinoline
CID 163899089

Frequently Asked Questions

What is the IUPAC name of ethane;(6-methoxyquinolin-3-yl)methanol?
The IUPAC name of ethane;(6-methoxyquinolin-3-yl)methanol (CID 174710700) is ethane;(6-methoxyquinolin-3-yl)methanol.
What is the SMILES notation for ethane;(6-methoxyquinolin-3-yl)methanol?
The canonical SMILES for ethane;(6-methoxyquinolin-3-yl)methanol is CC.COc1ccc2ncc(CO)cc2c1.
What is the InChIKey of ethane;(6-methoxyquinolin-3-yl)methanol?
The InChIKey is KMMINANZMCXXSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2.C2H6/c1-14-10-2-3-11-9(5-10)4-8(7-13)6-12-11;1-2/h2-6,13H,7H2,1H3;1-2H3.
What are the key properties of ethane;(6-methoxyquinolin-3-yl)methanol?
ethane;(6-methoxyquinolin-3-yl)methanol has a molecular weight of 219.28 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(6-methoxyquinolin-3-yl)methanol is sourced from PubChem (CID 174710700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).