[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine

C14H16N2O2 — CID 43122520

IUPAC[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine
SMILESCOc1ccc(CN)cc1OCc1cccnc1
InChIInChI=1S/C14H16N2O2/c1-17-13-5-4-11(8-15)7-14(13)18-10-12-3-2-6-16-9-12/h2-7,9H,8,10,15H2,1H3
InChIKeyWYUPQKNMZZNRFJ-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.13
Rot. Bonds5

About [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine

[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine (PubChem CID 43122520) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine.

Molecular Properties

Compound Name[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine
PubChem CID43122520
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine
SMILESCOc1ccc(CN)cc1OCc1cccnc1
InChIInChI=1S/C14H16N2O2/c1-17-13-5-4-11(8-15)7-14(13)18-10-12-3-2-6-16-9-12/h2-7,9H,8,10,15H2,1H3
InChIKeyWYUPQKNMZZNRFJ-UHFFFAOYSA-N
XLogP2.13
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methanamine;hydrochloride
CID 42892412
(4-methoxy-3-phenylmethoxyphenyl)methanamine
CID 12649335
[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methanol
CID 28562159
3-[[4-(bromomethyl)-2-methoxyphenoxy]methyl]pyridine
CID 43324725
1-[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]-N-methylmethanamine
CID 43278584
ethyl 4-methoxy-3-(pyridin-3-ylmethoxy)benzoate
CID 91682546
[2-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methanamine
CID 69143790
N'-hydroxy-3-methoxy-4-(pyridin-3-ylmethoxy)benzenecarboximidamide
CID 24706507
N-[(5-ethylthiophen-2-yl)methyl]-1-[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine
CID 119111433
[3-methoxy-4-[(3-methoxyphenyl)methoxy]phenyl]methanamine
CID 60879812
[3,5-dimethoxy-4-(2-pyridin-3-ylethoxy)phenyl]methanamine
CID 63265023
[4-methoxy-3-(1,3-thiazol-5-ylmethoxy)phenyl]methanamine
CID 112640286

Frequently Asked Questions

What is the IUPAC name of [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine?
The IUPAC name of [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine (CID 43122520) is [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine.
What is the SMILES notation for [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine?
The canonical SMILES for [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine is COc1ccc(CN)cc1OCc1cccnc1.
What is the InChIKey of [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine?
The InChIKey is WYUPQKNMZZNRFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-17-13-5-4-11(8-15)7-14(13)18-10-12-3-2-6-16-9-12/h2-7,9H,8,10,15H2,1H3.
What are the key properties of [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine?
[4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine has a molecular weight of 244.29 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-3-(pyridin-3-ylmethoxy)phenyl]methanamine is sourced from PubChem (CID 43122520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).