2-[benzyl(methyl)amino]-4-methylquinolin-7-ol

C18H18N2O — CID 135522122

IUPAC2-[benzyl(methyl)amino]-4-methylquinolin-7-ol
SMILESCc1cc(N(C)Cc2ccccc2)nc2cc(O)ccc12
InChIInChI=1S/C18H18N2O/c1-13-10-18(19-17-11-15(21)8-9-16(13)17)20(2)12-14-6-4-3-5-7-14/h3-11,21H,12H2,1-2H3
InChIKeyQDKXKKMLPLCVAW-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.89
Rot. Bonds3

About 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol

2-[benzyl(methyl)amino]-4-methylquinolin-7-ol (PubChem CID 135522122) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol.

Molecular Properties

Compound Name2-[benzyl(methyl)amino]-4-methylquinolin-7-ol
PubChem CID135522122
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-[benzyl(methyl)amino]-4-methylquinolin-7-ol
SMILESCc1cc(N(C)Cc2ccccc2)nc2cc(O)ccc12
InChIInChI=1S/C18H18N2O/c1-13-10-18(19-17-11-15(21)8-9-16(13)17)20(2)12-14-6-4-3-5-7-14/h3-11,21H,12H2,1-2H3
InChIKeyQDKXKKMLPLCVAW-UHFFFAOYSA-N
XLogP3.89
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol?
The IUPAC name of 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol (CID 135522122) is 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol.
What is the SMILES notation for 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol?
The canonical SMILES for 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol is Cc1cc(N(C)Cc2ccccc2)nc2cc(O)ccc12.
What is the InChIKey of 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol?
The InChIKey is QDKXKKMLPLCVAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-10-18(19-17-11-15(21)8-9-16(13)17)20(2)12-14-6-4-3-5-7-14/h3-11,21H,12H2,1-2H3.
What are the key properties of 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol?
2-[benzyl(methyl)amino]-4-methylquinolin-7-ol has a molecular weight of 278.36 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(methyl)amino]-4-methylquinolin-7-ol is sourced from PubChem (CID 135522122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).