5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine

C22H19N3O — CID 11588162

IUPAC5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine
SMILESCOc1cncc(-c2cncc(NCc3ccc4ccccc4c3)c2)c1
InChIInChI=1S/C22H19N3O/c1-26-22-10-20(13-24-15-22)19-9-21(14-23-12-19)25-11-16-6-7-17-4-2-3-5-18(17)8-16/h2-10,12-15,25H,11H2,1H3
InChIKeyNDQRSYJSJLBCEJ-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.92
Rot. Bonds5

About 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine

5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine (PubChem CID 11588162) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine.

Molecular Properties

Compound Name5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine
PubChem CID11588162
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC Name5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine
SMILESCOc1cncc(-c2cncc(NCc3ccc4ccccc4c3)c2)c1
InChIInChI=1S/C22H19N3O/c1-26-22-10-20(13-24-15-22)19-9-21(14-23-12-19)25-11-16-6-7-17-4-2-3-5-18(17)8-16/h2-10,12-15,25H,11H2,1H3
InChIKeyNDQRSYJSJLBCEJ-UHFFFAOYSA-N
XLogP4.92
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(isoquinolin-6-ylmethyl)-3-methoxyaniline
CID 107037607
3-(methoxymethyl)-N-(naphthalen-2-ylmethyl)aniline
CID 43672062
N-[(5-methoxy-3-pyridinyl)methyl]-1H-pyrrol-3-amine
CID 69114857
N-(naphthalen-2-ylmethyl)-1H-pyrrol-3-amine
CID 141147777
4-[[(5-fluoro-3-pyridinyl)amino]methyl]-2-methoxyphenol
CID 114254373
4-fluoro-N-[(6-methoxynaphthalen-2-yl)methyl]aniline
CID 29054094
3-[[[5-(2,4-dimethoxypyrimidin-5-yl)-3-pyridinyl]amino]methyl]phenol
CID 11976379
3-bromo-N-(naphthalen-2-ylmethyl)aniline
CID 28555096
N-[(4-methoxyphenyl)methyl]-6-phenylmethoxynaphthalen-2-amine
CID 25139545
N-(naphthalen-2-ylmethyl)-1H-indazol-5-amine
CID 762796
[4-[5-[(3,4-dichlorophenyl)methylamino]-3-pyridinyl]phenyl]methanol
CID 71424003
N-[(3,4-dichlorophenyl)methyl]-3-(5-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazin-6-amine
CID 126475837

Frequently Asked Questions

What is the IUPAC name of 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine?
The IUPAC name of 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine (CID 11588162) is 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine.
What is the SMILES notation for 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine?
The canonical SMILES for 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine is COc1cncc(-c2cncc(NCc3ccc4ccccc4c3)c2)c1.
What is the InChIKey of 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine?
The InChIKey is NDQRSYJSJLBCEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-26-22-10-20(13-24-15-22)19-9-21(14-23-12-19)25-11-16-6-7-17-4-2-3-5-18(17)8-16/h2-10,12-15,25H,11H2,1H3.
What are the key properties of 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine?
5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine has a molecular weight of 341.41 g/mol, XLogP of 4.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methoxy-3-pyridinyl)-N-(naphthalen-2-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 11588162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).