(2-methyl-6-phenoxyquinolin-3-yl)methanamine

C17H16N2O — CID 82246665

IUPAC(2-methyl-6-phenoxyquinolin-3-yl)methanamine
SMILESCc1nc2ccc(Oc3ccccc3)cc2cc1CN
InChIInChI=1S/C17H16N2O/c1-12-14(11-18)9-13-10-16(7-8-17(13)19-12)20-15-5-3-2-4-6-15/h2-10H,11,18H2,1H3
InChIKeyMRZHZTHPQGCCSJ-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.79
Rot. Bonds3

About (2-methyl-6-phenoxyquinolin-3-yl)methanamine

(2-methyl-6-phenoxyquinolin-3-yl)methanamine (PubChem CID 82246665) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is (2-methyl-6-phenoxyquinolin-3-yl)methanamine.

Molecular Properties

Compound Name(2-methyl-6-phenoxyquinolin-3-yl)methanamine
PubChem CID82246665
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name(2-methyl-6-phenoxyquinolin-3-yl)methanamine
SMILESCc1nc2ccc(Oc3ccccc3)cc2cc1CN
InChIInChI=1S/C17H16N2O/c1-12-14(11-18)9-13-10-16(7-8-17(13)19-12)20-15-5-3-2-4-6-15/h2-10H,11,18H2,1H3
InChIKeyMRZHZTHPQGCCSJ-UHFFFAOYSA-N
XLogP3.79
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-phenoxyquinazolin-2-amine
CID 151514344
(2,3-dimethyl-6-phenoxyquinolin-4-yl)hydrazine
CID 63482258
2-(aminomethyl)-N,N-dimethyl-6-phenoxyquinolin-4-amine
CID 82251171
(2-ethoxy-5-phenoxyphenyl)methanamine
CID 82267172
2-ethyl-6-phenoxyquinolin-4-amine
CID 62196105
[2-(4-phenoxyphenyl)phenyl]methanamine
CID 61033125
2-(methoxymethyl)-6-phenoxyquinolin-4-amine
CID 62318979
[2-(3-iodophenoxy)quinolin-3-yl]methanamine
CID 43327394
3-ethyl-2-methyl-6-[(E)-2-phenylethenyl]quinoline
CID 21061110
(2-carbamoyl-6-phenoxyquinolin-3-yl) acetate
CID 174474043
[2-(4-methylsulfanylphenoxy)quinolin-3-yl]methanamine
CID 63648716
(2,3-dimethyl-6-phenoxyquinolin-4-yl) acetate
CID 58956897

Frequently Asked Questions

What is the IUPAC name of (2-methyl-6-phenoxyquinolin-3-yl)methanamine?
The IUPAC name of (2-methyl-6-phenoxyquinolin-3-yl)methanamine (CID 82246665) is (2-methyl-6-phenoxyquinolin-3-yl)methanamine.
What is the SMILES notation for (2-methyl-6-phenoxyquinolin-3-yl)methanamine?
The canonical SMILES for (2-methyl-6-phenoxyquinolin-3-yl)methanamine is Cc1nc2ccc(Oc3ccccc3)cc2cc1CN.
What is the InChIKey of (2-methyl-6-phenoxyquinolin-3-yl)methanamine?
The InChIKey is MRZHZTHPQGCCSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12-14(11-18)9-13-10-16(7-8-17(13)19-12)20-15-5-3-2-4-6-15/h2-10H,11,18H2,1H3.
What are the key properties of (2-methyl-6-phenoxyquinolin-3-yl)methanamine?
(2-methyl-6-phenoxyquinolin-3-yl)methanamine has a molecular weight of 264.33 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-6-phenoxyquinolin-3-yl)methanamine is sourced from PubChem (CID 82246665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).