[4-(4-phenylmethoxyphenoxy)phenyl]methanamine

C20H19NO2 — CID 139985270

IUPAC[4-(4-phenylmethoxyphenoxy)phenyl]methanamine
SMILESNCc1ccc(Oc2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C20H19NO2/c21-14-16-6-8-19(9-7-16)23-20-12-10-18(11-13-20)22-15-17-4-2-1-3-5-17/h1-13H,14-15,21H2
InChIKeyWQBRNNVRLTUIQN-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.52
Rot. Bonds6

About [4-(4-phenylmethoxyphenoxy)phenyl]methanamine

[4-(4-phenylmethoxyphenoxy)phenyl]methanamine (PubChem CID 139985270) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is [4-(4-phenylmethoxyphenoxy)phenyl]methanamine.

Molecular Properties

Compound Name[4-(4-phenylmethoxyphenoxy)phenyl]methanamine
PubChem CID139985270
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Name[4-(4-phenylmethoxyphenoxy)phenyl]methanamine
SMILESNCc1ccc(Oc2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C20H19NO2/c21-14-16-6-8-19(9-7-16)23-20-12-10-18(11-13-20)22-15-17-4-2-1-3-5-17/h1-13H,14-15,21H2
InChIKeyWQBRNNVRLTUIQN-UHFFFAOYSA-N
XLogP4.52
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3-fluoro-4-phenylmethoxyphenoxy)phenyl]methanamine
CID 143961012
[4-(4-phenylmethoxyphenoxy)-2-pyridinyl]methanamine
CID 69017208
1-(benzylperoxymethyl)-4-[[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]methoxy]benzene
CID 156694250
1-chloro-4-[(4-phenoxyphenoxy)methyl]benzene
CID 54171722
[4-[(4-ethoxyphenoxy)methyl]phenyl]methanamine
CID 16787344
4-phenylmethoxyaniline
CID 159966727
4-(3-phenylmethoxyphenoxy)aniline
CID 89036367
1-bromo-3-(4-phenylmethoxyphenoxy)benzene
CID 44818238
[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methanamine
CID 101273679
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
2-[4-[3-(4-phenylmethoxyphenoxy)propoxy]phenyl]ethanamine
CID 170868663
8-(4-phenylmethoxyphenoxy)octan-1-amine
CID 16720538

Frequently Asked Questions

What is the IUPAC name of [4-(4-phenylmethoxyphenoxy)phenyl]methanamine?
The IUPAC name of [4-(4-phenylmethoxyphenoxy)phenyl]methanamine (CID 139985270) is [4-(4-phenylmethoxyphenoxy)phenyl]methanamine.
What is the SMILES notation for [4-(4-phenylmethoxyphenoxy)phenyl]methanamine?
The canonical SMILES for [4-(4-phenylmethoxyphenoxy)phenyl]methanamine is NCc1ccc(Oc2ccc(OCc3ccccc3)cc2)cc1.
What is the InChIKey of [4-(4-phenylmethoxyphenoxy)phenyl]methanamine?
The InChIKey is WQBRNNVRLTUIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c21-14-16-6-8-19(9-7-16)23-20-12-10-18(11-13-20)22-15-17-4-2-1-3-5-17/h1-13H,14-15,21H2.
What are the key properties of [4-(4-phenylmethoxyphenoxy)phenyl]methanamine?
[4-(4-phenylmethoxyphenoxy)phenyl]methanamine has a molecular weight of 305.38 g/mol, XLogP of 4.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-phenylmethoxyphenoxy)phenyl]methanamine is sourced from PubChem (CID 139985270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).