N-[(2-ethoxyphenyl)methyl]quinolin-3-amine

C18H18N2O — CID 43691162

IUPACN-[(2-ethoxyphenyl)methyl]quinolin-3-amine
SMILESCCOc1ccccc1CNc1cnc2ccccc2c1
InChIInChI=1S/C18H18N2O/c1-2-21-18-10-6-4-8-15(18)12-19-16-11-14-7-3-5-9-17(14)20-13-16/h3-11,13,19H,2,12H2,1H3
InChIKeyLZVMQTODMUPUMK-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.25
Rot. Bonds5

About N-[(2-ethoxyphenyl)methyl]quinolin-3-amine

N-[(2-ethoxyphenyl)methyl]quinolin-3-amine (PubChem CID 43691162) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[(2-ethoxyphenyl)methyl]quinolin-3-amine.

Molecular Properties

Compound NameN-[(2-ethoxyphenyl)methyl]quinolin-3-amine
PubChem CID43691162
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-[(2-ethoxyphenyl)methyl]quinolin-3-amine
SMILESCCOc1ccccc1CNc1cnc2ccccc2c1
InChIInChI=1S/C18H18N2O/c1-2-21-18-10-6-4-8-15(18)12-19-16-11-14-7-3-5-9-17(14)20-13-16/h3-11,13,19H,2,12H2,1H3
InChIKeyLZVMQTODMUPUMK-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

N-[(4-ethylphenyl)methyl]quinolin-3-amine
CID 43691167
2-[(quinolin-3-ylamino)methyl]benzonitrile
CID 104694112
2-fluoro-6-[(quinolin-3-ylamino)methyl]phenol
CID 115951211
N-(1H-indol-7-ylmethyl)quinolin-3-amine
CID 104624378
N-[(2-nitrophenyl)methyl]quinolin-3-amine
CID 43691125
1-N-[(2-ethoxyphenyl)methyl]-3-N,3-N-dimethylbenzene-1,3-diamine
CID 78913927
N-[(4-chloro-2-fluorophenyl)methyl]quinolin-3-amine
CID 114841721
N-[(2-ethoxyphenyl)methyl]-1-methylpyrazol-4-amine
CID 43535024
N-[(2-ethoxyphenyl)methyl]-2-methyl-3H-benzimidazol-5-amine
CID 43746372
N-[(2-ethoxyphenyl)methyl]-2-methyl-1,3-benzothiazol-6-amine
CID 43231044
4-chloro-N-[(2-ethoxyphenyl)methyl]aniline
CID 900682
N-[(2-ethoxyphenyl)methyl]-3-fluoroaniline
CID 23793082

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxyphenyl)methyl]quinolin-3-amine?
The IUPAC name of N-[(2-ethoxyphenyl)methyl]quinolin-3-amine (CID 43691162) is N-[(2-ethoxyphenyl)methyl]quinolin-3-amine.
What is the SMILES notation for N-[(2-ethoxyphenyl)methyl]quinolin-3-amine?
The canonical SMILES for N-[(2-ethoxyphenyl)methyl]quinolin-3-amine is CCOc1ccccc1CNc1cnc2ccccc2c1.
What is the InChIKey of N-[(2-ethoxyphenyl)methyl]quinolin-3-amine?
The InChIKey is LZVMQTODMUPUMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-2-21-18-10-6-4-8-15(18)12-19-16-11-14-7-3-5-9-17(14)20-13-16/h3-11,13,19H,2,12H2,1H3.
What are the key properties of N-[(2-ethoxyphenyl)methyl]quinolin-3-amine?
N-[(2-ethoxyphenyl)methyl]quinolin-3-amine 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 N-[(2-ethoxyphenyl)methyl]quinolin-3-amine is sourced from PubChem (CID 43691162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).