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

C18H18N2O — CID 28774803

IUPAC2-ethoxy-N-(quinolin-2-ylmethyl)aniline
SMILESCCOc1ccccc1NCc1ccc2ccccc2n1
InChIInChI=1S/C18H18N2O/c1-2-21-18-10-6-5-9-17(18)19-13-15-12-11-14-7-3-4-8-16(14)20-15/h3-12,19H,2,13H2,1H3
InChIKeyIYBGCVRECJRHIL-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.25
Rot. Bonds5

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

2-ethoxy-N-(quinolin-2-ylmethyl)aniline (PubChem CID 28774803) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-ethoxy-N-(quinolin-2-ylmethyl)aniline.

Molecular Properties

Compound Name2-ethoxy-N-(quinolin-2-ylmethyl)aniline
PubChem CID28774803
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-ethoxy-N-(quinolin-2-ylmethyl)aniline
SMILESCCOc1ccccc1NCc1ccc2ccccc2n1
InChIInChI=1S/C18H18N2O/c1-2-21-18-10-6-5-9-17(18)19-13-15-12-11-14-7-3-4-8-16(14)20-15/h3-12,19H,2,13H2,1H3
InChIKeyIYBGCVRECJRHIL-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

2-ethoxy-N-[(6-methoxy-2-pyridinyl)methyl]aniline
CID 63991749
2-methoxy-N-(quinolin-2-ylmethyl)pyridin-3-amine
CID 64955346
2-methylsulfanyl-N-(quinolin-2-ylmethyl)aniline
CID 60680732
2-ethoxy-N-(quinolin-8-ylmethyl)aniline
CID 28612848
2,3,4-trifluoro-N-(quinolin-2-ylmethyl)aniline
CID 28774815
2-ethoxy-2-methyl-N-(quinolin-2-ylmethyl)propan-1-amine
CID 114941479
[2-(2-ethoxyanilino)-2-oxoethyl] 3-quinolin-2-ylprop-2-enoate
CID 71953117
2-[(2-ethoxyanilino)methyl]aniline
CID 66385823
N-[(2-methylpyrimidin-4-yl)methyl]-2-propoxyaniline
CID 62748401
N-(quinolin-2-ylmethyl)pentan-3-amine
CID 28774778
4-bromo-2-chloro-N-(quinolin-2-ylmethyl)aniline
CID 43236879
ethyl 2-[4-(quinolin-2-ylmethylamino)phenoxy]propanoate
CID 171812265

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(quinolin-2-ylmethyl)aniline?
The IUPAC name of 2-ethoxy-N-(quinolin-2-ylmethyl)aniline (CID 28774803) is 2-ethoxy-N-(quinolin-2-ylmethyl)aniline.
What is the SMILES notation for 2-ethoxy-N-(quinolin-2-ylmethyl)aniline?
The canonical SMILES for 2-ethoxy-N-(quinolin-2-ylmethyl)aniline is CCOc1ccccc1NCc1ccc2ccccc2n1.
What is the InChIKey of 2-ethoxy-N-(quinolin-2-ylmethyl)aniline?
The InChIKey is IYBGCVRECJRHIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-2-21-18-10-6-5-9-17(18)19-13-15-12-11-14-7-3-4-8-16(14)20-15/h3-12,19H,2,13H2,1H3.
What are the key properties of 2-ethoxy-N-(quinolin-2-ylmethyl)aniline?
2-ethoxy-N-(quinolin-2-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-2-ylmethyl)aniline is sourced from PubChem (CID 28774803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).