6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine

C26H20N4O — CID 122387844

IUPAC6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine
SMILESNc1ccc(-c2ccc(OCc3ccc4ccccc4n3)cc2)c(-c2cccnc2)n1
InChIInChI=1S/C26H20N4O/c27-25-14-13-23(26(30-25)20-5-3-15-28-16-20)18-8-11-22(12-9-18)31-17-21-10-7-19-4-1-2-6-24(19)29-21/h1-16H,17H2,(H2,27,30)
InChIKeyQGYFGJKVNKSBEF-UHFFFAOYSA-N
MW404.47 g/mol
LogP5.52
Rot. Bonds5

About 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine

6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine (PubChem CID 122387844) has the molecular formula C26H20N4O and a molecular weight of 404.47 g/mol. Its IUPAC name is 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine.

Molecular Properties

Compound Name6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine
PubChem CID122387844
Molecular FormulaC26H20N4O
Molecular Weight404.47 g/mol
Exact Mass404.16
IUPAC Name6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine
SMILESNc1ccc(-c2ccc(OCc3ccc4ccccc4n3)cc2)c(-c2cccnc2)n1
InChIInChI=1S/C26H20N4O/c27-25-14-13-23(26(30-25)20-5-3-15-28-16-20)18-8-11-22(12-9-18)31-17-21-10-7-19-4-1-2-6-24(19)29-21/h1-16H,17H2,(H2,27,30)
InChIKeyQGYFGJKVNKSBEF-UHFFFAOYSA-N
XLogP5.52
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.47
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-phenyl-5-[4-(1H-pyrrolo[3,2-b]pyridin-5-ylmethoxy)phenyl]pyridin-2-amine
CID 122387847
4-pyridin-3-yl-6-(quinolin-2-ylmethoxy)quinazoline
CID 24944954
2-[[4-(1-methyl-4-pyridin-4-ylpyrazol-5-yl)phenoxy]methyl]quinoline
CID 11668304
[4-(quinolin-2-ylmethoxy)phenyl]methanamine
CID 28773235
2-[[4-(2-pyridin-4-ylethynyl)phenoxy]methyl]quinoline
CID 59797507
[6-(2,4-difluorophenyl)-5-[4-(quinolin-2-ylmethoxy)phenyl]-2-pyridinyl] acetate
CID 122196415
5-pyridin-4-yl-4-[4-(quinolin-2-ylmethoxy)phenyl]-1,3-oxazole
CID 11603302
4-fluoro-2-[4-(quinolin-2-ylmethoxy)phenyl]phenol
CID 67026414
3-pyridin-4-yl-2-[4-(quinolin-2-ylmethoxy)phenyl]benzonitrile
CID 44600240
ethyl 2-[4-pyridin-4-yl-3-[4-(quinolin-2-ylmethoxy)phenyl]pyrazol-1-yl]acetate
CID 167444594
4-[4-(quinolin-2-ylmethoxy)phenyl]benzoic acid
CID 168875197
2-[[4-(2-methyl-6-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-yl)phenoxy]methyl]quinoline
CID 11662225

Frequently Asked Questions

What is the IUPAC name of 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine?
The IUPAC name of 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine (CID 122387844) is 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine.
What is the SMILES notation for 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine?
The canonical SMILES for 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine is Nc1ccc(-c2ccc(OCc3ccc4ccccc4n3)cc2)c(-c2cccnc2)n1.
What is the InChIKey of 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine?
The InChIKey is QGYFGJKVNKSBEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N4O/c27-25-14-13-23(26(30-25)20-5-3-15-28-16-20)18-8-11-22(12-9-18)31-17-21-10-7-19-4-1-2-6-24(19)29-21/h1-16H,17H2,(H2,27,30).
What are the key properties of 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine?
6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine has a molecular weight of 404.47 g/mol, XLogP of 5.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyridin-3-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]pyridin-2-amine is sourced from PubChem (CID 122387844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).