N,2-dimethyl-8-phenoxyquinolin-4-amine

C17H16N2O — CID 63481310

IUPACN,2-dimethyl-8-phenoxyquinolin-4-amine
SMILESCNc1cc(C)nc2c(Oc3ccccc3)cccc12
InChIInChI=1S/C17H16N2O/c1-12-11-15(18-2)14-9-6-10-16(17(14)19-12)20-13-7-4-3-5-8-13/h3-11H,1-2H3,(H,18,19)
InChIKeyMTXFACGMSAKOOZ-UHFFFAOYSA-N
MW264.33 g/mol
LogP4.38
Rot. Bonds3

About N,2-dimethyl-8-phenoxyquinolin-4-amine

N,2-dimethyl-8-phenoxyquinolin-4-amine (PubChem CID 63481310) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is N,2-dimethyl-8-phenoxyquinolin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-8-phenoxyquinolin-4-amine
PubChem CID63481310
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC NameN,2-dimethyl-8-phenoxyquinolin-4-amine
SMILESCNc1cc(C)nc2c(Oc3ccccc3)cccc12
InChIInChI=1S/C17H16N2O/c1-12-11-15(18-2)14-9-6-10-16(17(14)19-12)20-13-7-4-3-5-8-13/h3-11H,1-2H3,(H,18,19)
InChIKeyMTXFACGMSAKOOZ-UHFFFAOYSA-N
XLogP4.38
TPSA34.15 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 ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-8-phenoxyquinolin-4-amine?
The IUPAC name of N,2-dimethyl-8-phenoxyquinolin-4-amine (CID 63481310) is N,2-dimethyl-8-phenoxyquinolin-4-amine.
What is the SMILES notation for N,2-dimethyl-8-phenoxyquinolin-4-amine?
The canonical SMILES for N,2-dimethyl-8-phenoxyquinolin-4-amine is CNc1cc(C)nc2c(Oc3ccccc3)cccc12.
What is the InChIKey of N,2-dimethyl-8-phenoxyquinolin-4-amine?
The InChIKey is MTXFACGMSAKOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12-11-15(18-2)14-9-6-10-16(17(14)19-12)20-13-7-4-3-5-8-13/h3-11H,1-2H3,(H,18,19).
What are the key properties of N,2-dimethyl-8-phenoxyquinolin-4-amine?
N,2-dimethyl-8-phenoxyquinolin-4-amine has a molecular weight of 264.33 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-8-phenoxyquinolin-4-amine is sourced from PubChem (CID 63481310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).