4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine

C14H16N2O2 — CID 69307184

IUPAC4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine
SMILESCOc1cccc(COc2ccc(N)c(N)c2)c1
InChIInChI=1S/C14H16N2O2/c1-17-11-4-2-3-10(7-11)9-18-12-5-6-13(15)14(16)8-12/h2-8H,9,15-16H2,1H3
InChIKeyZHMZIVKTHGPNMR-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.44
Rot. Bonds4

About 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine

4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine (PubChem CID 69307184) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine.

Molecular Properties

Compound Name4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine
PubChem CID69307184
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine
SMILESCOc1cccc(COc2ccc(N)c(N)c2)c1
InChIInChI=1S/C14H16N2O2/c1-17-11-4-2-3-10(7-11)9-18-12-5-6-13(15)14(16)8-12/h2-8H,9,15-16H2,1H3
InChIKeyZHMZIVKTHGPNMR-UHFFFAOYSA-N
XLogP2.44
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine 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

5-[(3-methoxyphenyl)methoxy]-2-nitroaniline
CID 106751925
2-chloro-4-[(3-methoxyphenoxy)methyl]aniline
CID 117220355
1-chloro-3-[(3-methoxyphenyl)methoxy]benzene
CID 60627845
5-methoxy-2-(3-phenylmethoxyphenoxy)aniline
CID 166611417
4-[(3-methoxyphenyl)methoxy]-2-methylbenzenecarbothioamide
CID 81277331
3-[(3-methoxyphenyl)methoxy]-4-methylaniline
CID 43520224
2-[(3-methoxyphenyl)methoxy]-4-N,4-N-dimethylbenzene-1,4-diamine
CID 79589508
3-[(3-methoxyphenyl)methoxy]-5-propan-2-yloxyaniline
CID 80752679
4-[(3-methoxyphenyl)methoxy]-N-methylaniline
CID 39205064
2-[(3-methoxyphenyl)methoxy]pyridin-3-amine
CID 24708484
[5-[(3-methoxyphenyl)methoxy]-2-pyridinyl]methanamine
CID 79775923
1-ethenyl-4-[(3-methoxyphenyl)methoxy]benzene
CID 142732471

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine?
The IUPAC name of 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine (CID 69307184) is 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine.
What is the SMILES notation for 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine?
The canonical SMILES for 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine is COc1cccc(COc2ccc(N)c(N)c2)c1.
What is the InChIKey of 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine?
The InChIKey is ZHMZIVKTHGPNMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-17-11-4-2-3-10(7-11)9-18-12-5-6-13(15)14(16)8-12/h2-8H,9,15-16H2,1H3.
What are the key properties of 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine?
4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine has a molecular weight of 244.29 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine is sourced from PubChem (CID 69307184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).