4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride

C15H16Cl2N2O2 — CID 82240843

IUPAC4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc(OCc2ccc(Cl)cc2)c(OC)c1
InChIInChI=1S/C15H15ClN2O2.ClH/c1-19-14-8-11(15(17)18)4-7-13(14)20-9-10-2-5-12(16)6-3-10;/h2-8H,9H2,1H3,(H3,17,18);1H
InChIKeyZQNCBWOJPCDLOY-UHFFFAOYSA-N
MW327.21 g/mol
LogP3.63
Rot. Bonds5

About 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride

4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride (PubChem CID 82240843) has the molecular formula C15H16Cl2N2O2 and a molecular weight of 327.21 g/mol. Its IUPAC name is 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride.

Molecular Properties

Compound Name4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride
PubChem CID82240843
Molecular FormulaC15H16Cl2N2O2
Molecular Weight327.21 g/mol
Exact Mass326.06
IUPAC Name4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ccc(OCc2ccc(Cl)cc2)c(OC)c1
InChIInChI=1S/C15H15ClN2O2.ClH/c1-19-14-8-11(15(17)18)4-7-13(14)20-9-10-2-5-12(16)6-3-10;/h2-8H,9H2,1H3,(H3,17,18);1H
InChIKeyZQNCBWOJPCDLOY-UHFFFAOYSA-N
XLogP3.63
TPSA68.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.21
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride 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

3-methoxy-4-(pyridin-4-ylmethoxy)benzenecarboximidamide;hydrochloride
CID 82253528
4-[(2,6-dimethoxyphenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride
CID 82253903
3-[(5-chloro-2-methoxyphenyl)methoxy]-4-methylbenzenecarboximidamide
CID 107657180
5-[(4-chlorophenyl)methoxymethyl]-2-methoxybenzenecarboximidamide
CID 65339965
3-methoxy-4-propoxybenzenecarboximidamide
CID 24709016
3-[(2-methoxy-4-methylphenoxy)methyl]benzenecarboximidamide
CID 24709656
4-chloro-2-[(4-chlorophenyl)methoxy]benzenecarboximidamide
CID 65126032
5-[(4-chloro-2-methylphenoxy)methyl]-2-methoxybenzenecarboximidamide
CID 65340096
4-[(4-chlorophenyl)methoxy]-3-methoxy-N,N-dimethylbenzamide
CID 27678333
4-[(3,4-difluorophenyl)methoxy]-3-fluorobenzenecarboximidamide
CID 107666642
4-[[3-[(4-carbamimidoylphenyl)methoxy]-5-methoxyphenoxy]methyl]benzenecarboximidamide
CID 156508325
4-[(3,4-dimethylphenyl)methoxy]-3-fluorobenzenecarboximidamide
CID 107666681

Frequently Asked Questions

What is the IUPAC name of 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride?
The IUPAC name of 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride (CID 82240843) is 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride.
What is the SMILES notation for 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride?
The canonical SMILES for 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1ccc(OCc2ccc(Cl)cc2)c(OC)c1.
What is the InChIKey of 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride?
The InChIKey is ZQNCBWOJPCDLOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2.ClH/c1-19-14-8-11(15(17)18)4-7-13(14)20-9-10-2-5-12(16)6-3-10;/h2-8H,9H2,1H3,(H3,17,18);1H.
What are the key properties of 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride?
4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride has a molecular weight of 327.21 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-chlorophenyl)methoxy]-3-methoxybenzenecarboximidamide;hydrochloride is sourced from PubChem (CID 82240843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).