[2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine

C15H15ClFNO2 — CID 115982692

IUPAC[2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine
SMILESCOc1cccc(CN)c1OCc1cccc(F)c1Cl
InChIInChI=1S/C15H15ClFNO2/c1-19-13-7-3-4-10(8-18)15(13)20-9-11-5-2-6-12(17)14(11)16/h2-7H,8-9,18H2,1H3
InChIKeyQWQGPGHULIUZLX-UHFFFAOYSA-N
MW295.74 g/mol
LogP3.53
Rot. Bonds5

About [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine

[2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine (PubChem CID 115982692) has the molecular formula C15H15ClFNO2 and a molecular weight of 295.74 g/mol. Its IUPAC name is [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine.

Molecular Properties

Compound Name[2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine
PubChem CID115982692
Molecular FormulaC15H15ClFNO2
Molecular Weight295.74 g/mol
Exact Mass295.08
IUPAC Name[2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine
SMILESCOc1cccc(CN)c1OCc1cccc(F)c1Cl
InChIInChI=1S/C15H15ClFNO2/c1-19-13-7-3-4-10(8-18)15(13)20-9-11-5-2-6-12(17)14(11)16/h2-7H,8-9,18H2,1H3
InChIKeyQWQGPGHULIUZLX-UHFFFAOYSA-N
XLogP3.53
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.74
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine
CID 20987842
[4-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine
CID 115982659
3-[(2-chloro-3-fluorophenyl)methoxy]-4-methoxyaniline
CID 112651662
2-[2-[(2-chloro-3-fluorophenyl)methoxy]-3-fluorophenyl]ethanamine
CID 115984055
[2-[(3,4-dimethoxy-2-pyridinyl)methoxy]-3-fluorophenyl]methanamine
CID 103172064
2-[2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]ethanamine
CID 60904969
[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methanol
CID 2987070
(5-methoxynaphthalen-1-yl)methanamine
CID 59401298
2-[(2-chloro-3-fluorophenyl)methoxy]-3-methylaniline
CID 112651692
1-(bromomethyl)-2-[(2,3-difluorophenyl)methoxy]-3-methoxybenzene
CID 43659017
[3-chloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]methanamine
CID 115951928
[3-chloro-2-[(3-fluoro-4-methoxyphenyl)methoxy]phenyl]methanamine
CID 115951940

Frequently Asked Questions

What is the IUPAC name of [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine?
The IUPAC name of [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine (CID 115982692) is [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine.
What is the SMILES notation for [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine?
The canonical SMILES for [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine is COc1cccc(CN)c1OCc1cccc(F)c1Cl.
What is the InChIKey of [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine?
The InChIKey is QWQGPGHULIUZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFNO2/c1-19-13-7-3-4-10(8-18)15(13)20-9-11-5-2-6-12(17)14(11)16/h2-7H,8-9,18H2,1H3.
What are the key properties of [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine?
[2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine has a molecular weight of 295.74 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-chloro-3-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine is sourced from PubChem (CID 115982692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).