2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine

C18H18N2O — CID 107315468

IUPAC2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine
SMILESCc1ccc(CCN)cc1Oc1ccc2cccnc2c1
InChIInChI=1S/C18H18N2O/c1-13-4-5-14(8-9-19)11-18(13)21-16-7-6-15-3-2-10-20-17(15)12-16/h2-7,10-12H,8-9,19H2,1H3
InChIKeySJPKXESAPXZKOO-UHFFFAOYSA-N
MW278.35 g/mol
LogP3.84
Rot. Bonds4

About 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine

2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine (PubChem CID 107315468) has the molecular formula C18H18N2O and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine
PubChem CID107315468
Molecular FormulaC18H18N2O
Molecular Weight278.35 g/mol
Exact Mass278.14
IUPAC Name2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine
SMILESCc1ccc(CCN)cc1Oc1ccc2cccnc2c1
InChIInChI=1S/C18H18N2O/c1-13-4-5-14(8-9-19)11-18(13)21-16-7-6-15-3-2-10-20-17(15)12-16/h2-7,10-12H,8-9,19H2,1H3
InChIKeySJPKXESAPXZKOO-UHFFFAOYSA-N
XLogP3.84
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(3-fluoro-4-methylphenoxy)-4-methylphenyl]ethanamine
CID 107171085
2-(4-bromo-2-quinolin-7-yloxyphenyl)ethanamine
CID 107315464
5-fluoro-4-methyl-2-quinolin-7-yloxyaniline
CID 107313172
7-[4-(chloromethyl)-2-fluorophenoxy]quinoline
CID 107314176
3-quinolin-7-ylpropan-1-amine
CID 55268089
(6-quinolin-7-yloxy-3-pyridinyl)methanamine
CID 107313109
[3-methyl-4-(quinolin-7-yloxymethyl)phenyl]methanamine
CID 107313344
(2-quinolin-7-yloxypyrimidin-5-yl)methanamine
CID 107314265
7-[2-chloro-4-(chloromethyl)phenoxy]quinoline
CID 107314157
(2-methyl-4-quinolin-7-yloxyphenyl)methanol
CID 107314118
7-[4-(bromomethyl)-2-chlorophenoxy]quinoline
CID 107314175
(2-ethyl-6-quinolin-7-yloxy-4-pyridinyl)methanamine
CID 107314896

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine?
The IUPAC name of 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine (CID 107315468) is 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine.
What is the SMILES notation for 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine?
The canonical SMILES for 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine is Cc1ccc(CCN)cc1Oc1ccc2cccnc2c1.
What is the InChIKey of 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine?
The InChIKey is SJPKXESAPXZKOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-4-5-14(8-9-19)11-18(13)21-16-7-6-15-3-2-10-20-17(15)12-16/h2-7,10-12H,8-9,19H2,1H3.
What are the key properties of 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine?
2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine has a molecular weight of 278.35 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-3-quinolin-7-yloxyphenyl)ethanamine is sourced from PubChem (CID 107315468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).