2-ethoxy-N-(quinolin-8-ylmethyl)aniline

C18H18N2O — CID 28612848

IUPAC2-ethoxy-N-(quinolin-8-ylmethyl)aniline
SMILESCCOc1ccccc1NCc1cccc2cccnc12
InChIInChI=1S/C18H18N2O/c1-2-21-17-11-4-3-10-16(17)20-13-15-8-5-7-14-9-6-12-19-18(14)15/h3-12,20H,2,13H2,1H3
InChIKeyDEJFEKWEYTVTCM-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.25
Rot. Bonds5

About 2-ethoxy-N-(quinolin-8-ylmethyl)aniline

2-ethoxy-N-(quinolin-8-ylmethyl)aniline (PubChem CID 28612848) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-ethoxy-N-(quinolin-8-ylmethyl)aniline.

Molecular Properties

Compound Name2-ethoxy-N-(quinolin-8-ylmethyl)aniline
PubChem CID28612848
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-ethoxy-N-(quinolin-8-ylmethyl)aniline
SMILESCCOc1ccccc1NCc1cccc2cccnc12
InChIInChI=1S/C18H18N2O/c1-2-21-17-11-4-3-10-16(17)20-13-15-8-5-7-14-9-6-12-19-18(14)15/h3-12,20H,2,13H2,1H3
InChIKeyDEJFEKWEYTVTCM-UHFFFAOYSA-N
XLogP4.25
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-ethoxyanilino)methyl]pyridine-2-carbonitrile
CID 55128443
2-bromo-N-(quinolin-8-ylmethyl)aniline
CID 28616025
2-ethoxy-N-(naphthalen-1-ylmethyl)pyridin-3-amine
CID 43706191
2-N,2-N-dimethyl-1-N-(quinolin-8-ylmethyl)benzene-1,2-diamine
CID 43726392
2-[(2-ethoxyanilino)methyl]aniline
CID 66385823
N-(quinolin-8-ylmethyl)aniline
CID 28610045
2-methyl-N-(quinolin-8-ylmethyl)propan-2-amine
CID 28608485
3-chloro-1-N-(quinolin-8-ylmethyl)benzene-1,2-diamine
CID 104834766
2-(2-bromo-4,5-diethoxyphenyl)-N-quinolin-8-ylacetamide
CID 27676108
4-N-(2-ethoxyphenyl)-2-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112904843
N-(2-ethoxyphenyl)-3-methyl-2-(quinolin-8-ylsulfonylamino)butanamide
CID 20950551
N-[(3-ethoxy-2-methoxyphenyl)methyl]-2-methoxyaniline
CID 43757786

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(quinolin-8-ylmethyl)aniline?
The IUPAC name of 2-ethoxy-N-(quinolin-8-ylmethyl)aniline (CID 28612848) is 2-ethoxy-N-(quinolin-8-ylmethyl)aniline.
What is the SMILES notation for 2-ethoxy-N-(quinolin-8-ylmethyl)aniline?
The canonical SMILES for 2-ethoxy-N-(quinolin-8-ylmethyl)aniline is CCOc1ccccc1NCc1cccc2cccnc12.
What is the InChIKey of 2-ethoxy-N-(quinolin-8-ylmethyl)aniline?
The InChIKey is DEJFEKWEYTVTCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-2-21-17-11-4-3-10-16(17)20-13-15-8-5-7-14-9-6-12-19-18(14)15/h3-12,20H,2,13H2,1H3.
What are the key properties of 2-ethoxy-N-(quinolin-8-ylmethyl)aniline?
2-ethoxy-N-(quinolin-8-ylmethyl)aniline has a molecular weight of 278.36 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(quinolin-8-ylmethyl)aniline is sourced from PubChem (CID 28612848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).