(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride

C13H10Cl3NO — CID 23355179

IUPAC(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride
SMILESCl.Nc1ccc(Cl)cc1C(=O)c1ccccc1Cl
InChIInChI=1S/C13H9Cl2NO.ClH/c14-8-5-6-12(16)10(7-8)13(17)9-3-1-2-4-11(9)15;/h1-7H,16H2;1H
InChIKeyWALZVVNZHRGZRS-UHFFFAOYSA-N
MW302.59 g/mol
LogP4.23
Rot. Bonds2

About (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride

(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride (PubChem CID 23355179) has the molecular formula C13H10Cl3NO and a molecular weight of 302.59 g/mol. Its IUPAC name is (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride.

Molecular Properties

Compound Name(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride
PubChem CID23355179
Molecular FormulaC13H10Cl3NO
Molecular Weight302.59 g/mol
Exact Mass300.98
IUPAC Name(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride
SMILESCl.Nc1ccc(Cl)cc1C(=O)c1ccccc1Cl
InChIInChI=1S/C13H9Cl2NO.ClH/c14-8-5-6-12(16)10(7-8)13(17)9-3-1-2-4-11(9)15;/h1-7H,16H2;1H
InChIKeyWALZVVNZHRGZRS-UHFFFAOYSA-N
XLogP4.23
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.59
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;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

(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone
CID 18069
(2-chlorophenyl)-(2,5-diaminophenyl)methanone;hydrochloride
CID 6429540
(2-chlorophenyl)-(5-chloro-2-sulfanylphenyl)methanone
CID 139700416
(2-amino-5-chlorophenyl)-(2-nitrophenyl)methanone
CID 15908933
(2-amino-5-chlorophenyl)-(2-chloro-6-fluorophenyl)methanone
CID 67505353
(2-amino-5-chlorophenyl)-(7-chloro-1H-indol-3-yl)methanone
CID 103475626
4-chloro-2-(2-chlorobenzoyl)benzenediazonium tetrafluoroborate
CID 175554622
bis(2-amino-4-chlorophenyl)methanone
CID 15130044
(5-chloro-2-isocyanatophenyl)-(2-chlorophenyl)methanone
CID 169352086
[2-(2-amino-5-chlorophenyl)phenyl]-phenylmethanone
CID 139344273
(2-amino-5-chlorophenyl)-(2-fluoro-3-methoxyphenyl)methanone
CID 90097176
(2-amino-5-methyl-4-phenylphenyl)-(2-chlorophenyl)methanone
CID 143211334

Frequently Asked Questions

What is the IUPAC name of (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride?
The IUPAC name of (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride (CID 23355179) is (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride.
What is the SMILES notation for (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride?
The canonical SMILES for (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride is Cl.Nc1ccc(Cl)cc1C(=O)c1ccccc1Cl.
What is the InChIKey of (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride?
The InChIKey is WALZVVNZHRGZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2NO.ClH/c14-8-5-6-12(16)10(7-8)13(17)9-3-1-2-4-11(9)15;/h1-7H,16H2;1H.
What are the key properties of (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride?
(2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride has a molecular weight of 302.59 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone;hydrochloride is sourced from PubChem (CID 23355179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).