5-(4-benzylphenoxy)pyridin-3-amine

C18H16N2O — CID 104536724

IUPAC5-(4-benzylphenoxy)pyridin-3-amine
SMILESNc1cncc(Oc2ccc(Cc3ccccc3)cc2)c1
InChIInChI=1S/C18H16N2O/c19-16-11-18(13-20-12-16)21-17-8-6-15(7-9-17)10-14-4-2-1-3-5-14/h1-9,11-13H,10,19H2
InChIKeyIBFAVQZYHRAFDI-UHFFFAOYSA-N
MW276.34 g/mol
LogP4.05
Rot. Bonds4

About 5-(4-benzylphenoxy)pyridin-3-amine

5-(4-benzylphenoxy)pyridin-3-amine (PubChem CID 104536724) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 5-(4-benzylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-(4-benzylphenoxy)pyridin-3-amine
PubChem CID104536724
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name5-(4-benzylphenoxy)pyridin-3-amine
SMILESNc1cncc(Oc2ccc(Cc3ccccc3)cc2)c1
InChIInChI=1S/C18H16N2O/c19-16-11-18(13-20-12-16)21-17-8-6-15(7-9-17)10-14-4-2-1-3-5-14/h1-9,11-13H,10,19H2
InChIKeyIBFAVQZYHRAFDI-UHFFFAOYSA-N
XLogP4.05
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-phenylmethoxypyridin-3-amine
CID 22989735
6-(4-benzylphenoxy)pyridin-3-amine
CID 62274041
5-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyridin-3-amine
CID 113424380
ethane;1-phenoxy-4-[(4-phenoxyphenyl)methyl]benzene
CID 143793194
3-[4-[[2-[[4-(3-aminophenoxy)phenyl]methyl]phenyl]methyl]phenoxy]aniline
CID 141141650
4-[4-(3-phenylpropyl)phenoxy]aniline
CID 123730632
5-(2-propoxyphenoxy)pyridin-3-amine
CID 113424320
5-(3-fluoro-4-methylphenoxy)pyridin-3-amine
CID 107171750
5-(2-chloro-4-phenylphenoxy)pyridin-3-amine
CID 104536344
4-(4-benzylphenoxy)benzonitrile
CID 134587761
4-(4-benzylphenoxy)-3-bromopyridine
CID 104778913
5-(2-nitrophenoxy)pyridin-3-amine
CID 104536596

Frequently Asked Questions

What is the IUPAC name of 5-(4-benzylphenoxy)pyridin-3-amine?
The IUPAC name of 5-(4-benzylphenoxy)pyridin-3-amine (CID 104536724) is 5-(4-benzylphenoxy)pyridin-3-amine.
What is the SMILES notation for 5-(4-benzylphenoxy)pyridin-3-amine?
The canonical SMILES for 5-(4-benzylphenoxy)pyridin-3-amine is Nc1cncc(Oc2ccc(Cc3ccccc3)cc2)c1.
What is the InChIKey of 5-(4-benzylphenoxy)pyridin-3-amine?
The InChIKey is IBFAVQZYHRAFDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c19-16-11-18(13-20-12-16)21-17-8-6-15(7-9-17)10-14-4-2-1-3-5-14/h1-9,11-13H,10,19H2.
What are the key properties of 5-(4-benzylphenoxy)pyridin-3-amine?
5-(4-benzylphenoxy)pyridin-3-amine has a molecular weight of 276.34 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-benzylphenoxy)pyridin-3-amine is sourced from PubChem (CID 104536724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).