[4-(phenylmethoxymethyl)phenyl]methanamine

C15H17NO — CID 16789339

IUPAC[4-(phenylmethoxymethyl)phenyl]methanamine
SMILESNCc1ccc(COCc2ccccc2)cc1
InChIInChI=1S/C15H17NO/c16-10-13-6-8-15(9-7-13)12-17-11-14-4-2-1-3-5-14/h1-9H,10-12,16H2
InChIKeyJIOYDYXYKZIUOM-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.86
Rot. Bonds5

About [4-(phenylmethoxymethyl)phenyl]methanamine

[4-(phenylmethoxymethyl)phenyl]methanamine (PubChem CID 16789339) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is [4-(phenylmethoxymethyl)phenyl]methanamine.

Molecular Properties

Compound Name[4-(phenylmethoxymethyl)phenyl]methanamine
PubChem CID16789339
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name[4-(phenylmethoxymethyl)phenyl]methanamine
SMILESNCc1ccc(COCc2ccccc2)cc1
InChIInChI=1S/C15H17NO/c16-10-13-6-8-15(9-7-13)12-17-11-14-4-2-1-3-5-14/h1-9H,10-12,16H2
InChIKeyJIOYDYXYKZIUOM-UHFFFAOYSA-N
XLogP2.86
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(Aminomethyl)phenyl]methanol
CID 6496943
4-(Benzyloxy)butan-1-amine
CID 18322329
[4-(1,3-Dioxolan-2-yl)phenyl]methanamine
CID 10559254
(S)-2-(3,5-Dimethyl-benzyloxy)-1-phenyl-ethylamine
CID 44308930
(3-(Methoxymethyl)phenyl)methanamine
CID 16787292
1-[2-(Methoxymethyl)phenyl]methanamine
CID 12628891
(4-((2,2,2-Trifluoroethoxy)methyl)phenyl)methanamine
CID 16227394
(2-((Propan-2-yloxy)methyl)phenyl)methanamine
CID 18070374
{3-[(Tert-butoxy)methyl]phenyl}methanamine
CID 28996105
{4-[(Oxan-4-yloxy)methyl]phenyl}methanamine
CID 57656432
1-(4-Methoxymethylphenyl)ethylamine
CID 591393
(4-(Dimethoxymethyl)phenyl)methanamine
CID 54283740

Frequently Asked Questions

What is the IUPAC name of [4-(phenylmethoxymethyl)phenyl]methanamine?
The IUPAC name of [4-(phenylmethoxymethyl)phenyl]methanamine (CID 16789339) is [4-(phenylmethoxymethyl)phenyl]methanamine.
What is the SMILES notation for [4-(phenylmethoxymethyl)phenyl]methanamine?
The canonical SMILES for [4-(phenylmethoxymethyl)phenyl]methanamine is NCc1ccc(COCc2ccccc2)cc1.
What is the InChIKey of [4-(phenylmethoxymethyl)phenyl]methanamine?
The InChIKey is JIOYDYXYKZIUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c16-10-13-6-8-15(9-7-13)12-17-11-14-4-2-1-3-5-14/h1-9H,10-12,16H2.
What are the key properties of [4-(phenylmethoxymethyl)phenyl]methanamine?
[4-(phenylmethoxymethyl)phenyl]methanamine has a molecular weight of 227.31 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(phenylmethoxymethyl)phenyl]methanamine is sourced from PubChem (CID 16789339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).