4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline

C10H14N2O2 — CID 142018135

IUPAC4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline
SMILESCO/C(=C\N)c1ccc(N)cc1OC
InChIInChI=1S/C10H14N2O2/c1-13-9-5-7(12)3-4-8(9)10(6-11)14-2/h3-6H,11-12H2,1-2H3/b10-6-
InChIKeyHMOANGYFUSARLK-POHAHGRESA-N
MW194.23 g/mol
LogP1.18
Rot. Bonds3

About 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline

4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline (PubChem CID 142018135) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline.

Molecular Properties

Compound Name4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline
PubChem CID142018135
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline
SMILESCO/C(=C\N)c1ccc(N)cc1OC
InChIInChI=1S/C10H14N2O2/c1-13-9-5-7(12)3-4-8(9)10(6-11)14-2/h3-6H,11-12H2,1-2H3/b10-6-
InChIKeyHMOANGYFUSARLK-POHAHGRESA-N
XLogP1.18
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(4-amino-2-methoxyphenyl)ethenol
CID 89240422
3-(4-amino-2-methoxyphenyl)-3-oxopropanoic acid
CID 146619681
2-[(4-amino-2-methoxybenzoyl)amino]acetic acid
CID 107207731
(4-amino-2-methoxyphenyl)-(3-methoxythiophen-2-yl)methanone
CID 113452764
4-amino-2-methoxy-N-[(1S)-1-thiophen-2-ylethyl]benzamide
CID 107207953
(2R)-2-[(4-amino-2-methoxybenzoyl)amino]propanoic acid
CID 107207808
(4-amino-2-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanone
CID 104784994
4-amino-2-methoxy-N-[(1S)-1-pyridin-4-ylethyl]benzamide
CID 107207961
4-amino-2-methoxy-N-(3-methylcyclobutyl)benzamide
CID 113467050
3-[(4-amino-2-methoxybenzoyl)amino]-2,2,3-trimethylbutanoic acid
CID 107207865
4-[(4-amino-2-methoxybenzoyl)amino]butanoic acid
CID 107207734
N-(5-amino-2-methoxyphenyl)hydroxylamine
CID 20540979

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline?
The IUPAC name of 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline (CID 142018135) is 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline.
What is the SMILES notation for 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline?
The canonical SMILES for 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline is CO/C(=C\N)c1ccc(N)cc1OC.
What is the InChIKey of 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline?
The InChIKey is HMOANGYFUSARLK-POHAHGRESA-N. The full InChI is InChI=1S/C10H14N2O2/c1-13-9-5-7(12)3-4-8(9)10(6-11)14-2/h3-6H,11-12H2,1-2H3/b10-6-.
What are the key properties of 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline?
4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline has a molecular weight of 194.23 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-2-amino-1-methoxyethenyl]-3-methoxyaniline is sourced from PubChem (CID 142018135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).