[5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol

C17H20N2O — CID 80628620

IUPAC[5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1N1CC(C)Cc2ccccc21
InChIInChI=1S/C17H20N2O/c1-12-7-15-5-3-4-6-16(15)19(10-12)17-13(2)8-14(11-20)9-18-17/h3-6,8-9,12,20H,7,10-11H2,1-2H3
InChIKeyWIFBFIRMJSIYHX-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.21
Rot. Bonds2

About [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol

[5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol (PubChem CID 80628620) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol
PubChem CID80628620
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name[5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1N1CC(C)Cc2ccccc21
InChIInChI=1S/C17H20N2O/c1-12-7-15-5-3-4-6-16(15)19(10-12)17-13(2)8-14(11-20)9-18-17/h3-6,8-9,12,20H,7,10-11H2,1-2H3
InChIKeyWIFBFIRMJSIYHX-UHFFFAOYSA-N
XLogP3.21
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol?
The IUPAC name of [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol (CID 80628620) is [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol?
The canonical SMILES for [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol is Cc1cc(CO)cnc1N1CC(C)Cc2ccccc21.
What is the InChIKey of [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol?
The InChIKey is WIFBFIRMJSIYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-7-15-5-3-4-6-16(15)19(10-12)17-13(2)8-14(11-20)9-18-17/h3-6,8-9,12,20H,7,10-11H2,1-2H3.
What are the key properties of [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol?
[5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol has a molecular weight of 268.36 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 80628620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).