[4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine

C19H18N2O2 — CID 69017208

IUPAC[4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine
SMILESNCc1cc(Oc2ccc(OCc3ccccc3)cc2)ccn1
InChIInChI=1S/C19H18N2O2/c20-13-16-12-19(10-11-21-16)23-18-8-6-17(7-9-18)22-14-15-4-2-1-3-5-15/h1-12H,13-14,20H2
InChIKeyHKNAFCPNTZEXML-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.91
Rot. Bonds6

About [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine

[4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine (PubChem CID 69017208) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine
PubChem CID69017208
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name[4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine
SMILESNCc1cc(Oc2ccc(OCc3ccccc3)cc2)ccn1
InChIInChI=1S/C19H18N2O2/c20-13-16-12-19(10-11-21-16)23-18-8-6-17(7-9-18)22-14-15-4-2-1-3-5-15/h1-12H,13-14,20H2
InChIKeyHKNAFCPNTZEXML-UHFFFAOYSA-N
XLogP3.91
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(4-phenylmethoxyphenoxy)phenyl]methanamine
CID 139985270
[4-(4-ethylphenoxy)-2-pyridinyl]methanamine
CID 62295885
2-ethyl-4-phenylmethoxypyridine
CID 130153338
[4-[[2-(aminomethyl)-4-pyridinyl]oxy]phenyl]methanesulfonamide
CID 134586819
[4-(3,4-dimethylphenoxy)-2-pyridinyl]methanamine
CID 62297494
1-bromo-3-(4-phenylmethoxyphenoxy)benzene
CID 44818238
4-(3-phenylmethoxyphenoxy)aniline
CID 89036367
2-(chloromethyl)-4-(4-phenylphenoxy)pyridine
CID 63446226
[4-(4-phenylphenoxy)-2-pyridinyl]methanol
CID 61255006
2-oxo-3-(4-phenylmethoxy-2-pyridinyl)propanoic acid
CID 91387791
[4-(2-ethoxyphenoxy)-2-pyridinyl]methanamine
CID 62298325
[4-(3-bromo-4-fluorophenoxy)-2-pyridinyl]methanamine
CID 83232159

Frequently Asked Questions

What is the IUPAC name of [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine?
The IUPAC name of [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine (CID 69017208) is [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine is NCc1cc(Oc2ccc(OCc3ccccc3)cc2)ccn1.
What is the InChIKey of [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine?
The InChIKey is HKNAFCPNTZEXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c20-13-16-12-19(10-11-21-16)23-18-8-6-17(7-9-18)22-14-15-4-2-1-3-5-15/h1-12H,13-14,20H2.
What are the key properties of [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine?
[4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine has a molecular weight of 306.37 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 69017208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).