(2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol

C17H16N2O2 — CID 105118483

IUPAC(2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol
SMILESCOc1ncccc1C(O)c1ccc2nc(C)ccc2c1
InChIInChI=1S/C17H16N2O2/c1-11-5-6-12-10-13(7-8-15(12)19-11)16(20)14-4-3-9-18-17(14)21-2/h3-10,16,20H,1-2H3
InChIKeyIZGQRDVEJHICSM-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.03
Rot. Bonds3

About (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol

(2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol (PubChem CID 105118483) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol.

Molecular Properties

Compound Name(2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol
PubChem CID105118483
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name(2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol
SMILESCOc1ncccc1C(O)c1ccc2nc(C)ccc2c1
InChIInChI=1S/C17H16N2O2/c1-11-5-6-12-10-13(7-8-15(12)19-11)16(20)14-4-3-9-18-17(14)21-2/h3-10,16,20H,1-2H3
InChIKeyIZGQRDVEJHICSM-UHFFFAOYSA-N
XLogP3.03
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol?
The IUPAC name of (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol (CID 105118483) is (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol.
What is the SMILES notation for (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol?
The canonical SMILES for (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol is COc1ncccc1C(O)c1ccc2nc(C)ccc2c1.
What is the InChIKey of (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol?
The InChIKey is IZGQRDVEJHICSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-11-5-6-12-10-13(7-8-15(12)19-11)16(20)14-4-3-9-18-17(14)21-2/h3-10,16,20H,1-2H3.
What are the key properties of (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol?
(2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol has a molecular weight of 280.33 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol is sourced from PubChem (CID 105118483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).