2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine

C19H18N2O — CID 11380731

IUPAC2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine
SMILESCOc1c(N)cc(/C=C\c2ccc3ccccc3c2)cc1N
InChIInChI=1S/C19H18N2O/c1-22-19-17(20)11-14(12-18(19)21)7-6-13-8-9-15-4-2-3-5-16(15)10-13/h2-12H,20-21H2,1H3/b7-6-
InChIKeyDUSCRKODPGAANJ-SREVYHEPSA-N
MW290.37 g/mol
LogP4.18
Rot. Bonds3

About 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine

2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine (PubChem CID 11380731) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine.

Molecular Properties

Compound Name2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine
PubChem CID11380731
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine
SMILESCOc1c(N)cc(/C=C\c2ccc3ccccc3c2)cc1N
InChIInChI=1S/C19H18N2O/c1-22-19-17(20)11-14(12-18(19)21)7-6-13-8-9-15-4-2-3-5-16(15)10-13/h2-12H,20-21H2,1H3/b7-6-
InChIKeyDUSCRKODPGAANJ-SREVYHEPSA-N
XLogP4.18
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine?
The IUPAC name of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine (CID 11380731) is 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine.
What is the SMILES notation for 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine?
The canonical SMILES for 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine is COc1c(N)cc(/C=C\c2ccc3ccccc3c2)cc1N.
What is the InChIKey of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine?
The InChIKey is DUSCRKODPGAANJ-SREVYHEPSA-N. The full InChI is InChI=1S/C19H18N2O/c1-22-19-17(20)11-14(12-18(19)21)7-6-13-8-9-15-4-2-3-5-16(15)10-13/h2-12H,20-21H2,1H3/b7-6-.
What are the key properties of 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine?
2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine has a molecular weight of 290.37 g/mol, XLogP of 4.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(Z)-2-naphthalen-2-ylethenyl]benzene-1,3-diamine is sourced from PubChem (CID 11380731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).