[4-(quinolin-2-ylmethoxy)phenyl]methanamine

C17H16N2O — CID 28773235

IUPAC[4-(quinolin-2-ylmethoxy)phenyl]methanamine
SMILESNCc1ccc(OCc2ccc3ccccc3n2)cc1
InChIInChI=1S/C17H16N2O/c18-11-13-5-9-16(10-6-13)20-12-15-8-7-14-3-1-2-4-17(14)19-15/h1-10H,11-12,18H2
InChIKeyPINONOALQNOSGV-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.27
Rot. Bonds4

About [4-(quinolin-2-ylmethoxy)phenyl]methanamine

[4-(quinolin-2-ylmethoxy)phenyl]methanamine (PubChem CID 28773235) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is [4-(quinolin-2-ylmethoxy)phenyl]methanamine.

Molecular Properties

Compound Name[4-(quinolin-2-ylmethoxy)phenyl]methanamine
PubChem CID28773235
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name[4-(quinolin-2-ylmethoxy)phenyl]methanamine
SMILESNCc1ccc(OCc2ccc3ccccc3n2)cc1
InChIInChI=1S/C17H16N2O/c18-11-13-5-9-16(10-6-13)20-12-15-8-7-14-3-1-2-4-17(14)19-15/h1-10H,11-12,18H2
InChIKeyPINONOALQNOSGV-UHFFFAOYSA-N
XLogP3.27
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[4-[(4-propylphenyl)methoxy]phenoxy]methyl]quinoline
CID 57057623
[4-(quinolin-2-ylmethoxy)phenyl]methyl methanesulfonate
CID 152710097
1,5-bis[4-(quinolin-2-ylmethoxy)phenyl]pentan-3-one
CID 10792807
4-(quinolin-2-ylmethoxy)benzonitrile
CID 19844724
2-[[4-(4-methoxybutyl)phenoxy]methyl]quinoline
CID 21280545
[3-chloro-4-(quinolin-2-ylmethoxy)phenyl]methanamine
CID 61389098
2-[[4-[[2-(chloromethyl)phenyl]methoxy]phenoxy]methyl]quinoline
CID 14650385
4-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]benzoyl chloride
CID 19856159
2-[[3-(bromomethyl)phenoxy]methyl]quinoline
CID 43324683
4-(quinolin-2-ylmethoxy)benzoyl chloride
CID 19762439
2-[[4-(2-pyridin-4-ylethynyl)phenoxy]methyl]quinoline
CID 59797507
(2-methoxy-2-oxoethyl) 2-[4-(quinolin-2-ylmethoxy)phenyl]acetate
CID 14500249

Frequently Asked Questions

What is the IUPAC name of [4-(quinolin-2-ylmethoxy)phenyl]methanamine?
The IUPAC name of [4-(quinolin-2-ylmethoxy)phenyl]methanamine (CID 28773235) is [4-(quinolin-2-ylmethoxy)phenyl]methanamine.
What is the SMILES notation for [4-(quinolin-2-ylmethoxy)phenyl]methanamine?
The canonical SMILES for [4-(quinolin-2-ylmethoxy)phenyl]methanamine is NCc1ccc(OCc2ccc3ccccc3n2)cc1.
What is the InChIKey of [4-(quinolin-2-ylmethoxy)phenyl]methanamine?
The InChIKey is PINONOALQNOSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c18-11-13-5-9-16(10-6-13)20-12-15-8-7-14-3-1-2-4-17(14)19-15/h1-10H,11-12,18H2.
What are the key properties of [4-(quinolin-2-ylmethoxy)phenyl]methanamine?
[4-(quinolin-2-ylmethoxy)phenyl]methanamine has a molecular weight of 264.33 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(quinolin-2-ylmethoxy)phenyl]methanamine is sourced from PubChem (CID 28773235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).