N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine

C18H18N2O — CID 62298208

IUPACN-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine
SMILESCNCc1cc(Oc2ccccc2C)nc2ccccc12
InChIInChI=1S/C18H18N2O/c1-13-7-3-6-10-17(13)21-18-11-14(12-19-2)15-8-4-5-9-16(15)20-18/h3-11,19H,12H2,1-2H3
InChIKeyFOSPTKBXNITCTN-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.05
Rot. Bonds4

About N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine

N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine (PubChem CID 62298208) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine
PubChem CID62298208
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine
SMILESCNCc1cc(Oc2ccccc2C)nc2ccccc12
InChIInChI=1S/C18H18N2O/c1-13-7-3-6-10-17(13)21-18-11-14(12-19-2)15-8-4-5-9-16(15)20-18/h3-11,19H,12H2,1-2H3
InChIKeyFOSPTKBXNITCTN-UHFFFAOYSA-N
XLogP4.05
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2-methylphenoxy)quinolin-4-yl]methanamine
CID 62296104
1-[2-(4-chlorophenoxy)quinolin-4-yl]-N-methylmethanamine
CID 62297834
1-[2-(3-chlorophenoxy)quinolin-4-yl]-N-methylmethanamine
CID 62323576
4-(chloromethyl)-2-(2,3-dimethylphenoxy)quinoline
CID 63446236
1-[2-(1-ethylpyrazol-4-yl)oxyquinolin-4-yl]-N-methylmethanamine
CID 116802845
N-methyl-1-(2-quinolin-2-yloxyphenyl)methanamine
CID 106485480
N,N-diethyl-2-[4-(methylaminomethyl)quinolin-2-yl]oxyethanamine
CID 62296835
4-(2-methylphenoxy)quinazolin-2-amine
CID 80869397
4-(chloromethyl)-2-(2-chlorophenoxy)quinoline
CID 63446022
[2-(2-methylsulfanylphenoxy)quinolin-4-yl]methanol
CID 63648216
1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine
CID 43282630
2-(2-bromophenoxy)-4-(chloromethyl)quinoline
CID 63446400

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine?
The IUPAC name of N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine (CID 62298208) is N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine is CNCc1cc(Oc2ccccc2C)nc2ccccc12.
What is the InChIKey of N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine?
The InChIKey is FOSPTKBXNITCTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-7-3-6-10-17(13)21-18-11-14(12-19-2)15-8-4-5-9-16(15)20-18/h3-11,19H,12H2,1-2H3.
What are the key properties of N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine?
N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine has a molecular weight of 278.36 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(2-methylphenoxy)quinolin-4-yl]methanamine is sourced from PubChem (CID 62298208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).