N-(4-ethoxyphenyl)-4-methylquinolin-2-amine

C18H18N2O — CID 747022

IUPACN-(4-ethoxyphenyl)-4-methylquinolin-2-amine
SMILESCCOc1ccc(Nc2cc(C)c3ccccc3n2)cc1
InChIInChI=1S/C18H18N2O/c1-3-21-15-10-8-14(9-11-15)19-18-12-13(2)16-6-4-5-7-17(16)20-18/h4-12H,3H2,1-2H3,(H,19,20)
InChIKeyMEWSMMGVDHTULF-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.69
Rot. Bonds4

About N-(4-ethoxyphenyl)-4-methylquinolin-2-amine

N-(4-ethoxyphenyl)-4-methylquinolin-2-amine (PubChem CID 747022) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-4-methylquinolin-2-amine.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-4-methylquinolin-2-amine
PubChem CID747022
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-(4-ethoxyphenyl)-4-methylquinolin-2-amine
SMILESCCOc1ccc(Nc2cc(C)c3ccccc3n2)cc1
InChIInChI=1S/C18H18N2O/c1-3-21-15-10-8-14(9-11-15)19-18-12-13(2)16-6-4-5-7-17(16)20-18/h4-12H,3H2,1-2H3,(H,19,20)
InChIKeyMEWSMMGVDHTULF-UHFFFAOYSA-N
XLogP4.69
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 ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-4-methylquinolin-2-amine?
The IUPAC name of N-(4-ethoxyphenyl)-4-methylquinolin-2-amine (CID 747022) is N-(4-ethoxyphenyl)-4-methylquinolin-2-amine.
What is the SMILES notation for N-(4-ethoxyphenyl)-4-methylquinolin-2-amine?
The canonical SMILES for N-(4-ethoxyphenyl)-4-methylquinolin-2-amine is CCOc1ccc(Nc2cc(C)c3ccccc3n2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-4-methylquinolin-2-amine?
The InChIKey is MEWSMMGVDHTULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-3-21-15-10-8-14(9-11-15)19-18-12-13(2)16-6-4-5-7-17(16)20-18/h4-12H,3H2,1-2H3,(H,19,20).
What are the key properties of N-(4-ethoxyphenyl)-4-methylquinolin-2-amine?
N-(4-ethoxyphenyl)-4-methylquinolin-2-amine has a molecular weight of 278.36 g/mol, XLogP of 4.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-4-methylquinolin-2-amine is sourced from PubChem (CID 747022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).