1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine

C14H13Cl2FN2 — CID 65378776

IUPAC1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine
SMILESNCC(Nc1ccccc1F)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H13Cl2FN2/c15-10-5-3-4-9(14(10)16)13(8-18)19-12-7-2-1-6-11(12)17/h1-7,13,19H,8,18H2
InChIKeyFIOJMEGJXWVEHM-UHFFFAOYSA-N
MW299.18 g/mol
LogP4.24
Rot. Bonds4

About 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine

1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine (PubChem CID 65378776) has the molecular formula C14H13Cl2FN2 and a molecular weight of 299.18 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine
PubChem CID65378776
Molecular FormulaC14H13Cl2FN2
Molecular Weight299.18 g/mol
Exact Mass298.04
IUPAC Name1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine
SMILESNCC(Nc1ccccc1F)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H13Cl2FN2/c15-10-5-3-4-9(14(10)16)13(8-18)19-12-7-2-1-6-11(12)17/h1-7,13,19H,8,18H2
InChIKeyFIOJMEGJXWVEHM-UHFFFAOYSA-N
XLogP4.24
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.18
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-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

1-(2-chloro-6-fluorophenyl)-N-(2-chlorophenyl)ethane-1,2-diamine
CID 65378133
N,1-bis(2-chlorophenyl)ethane-1,2-diamine
CID 65377297
1-(5-chloro-2-fluorophenyl)-N-(2-chlorophenyl)ethane-1,2-diamine
CID 114843280
1-(2,5-difluorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine
CID 65377111
(1S)-1-(2,3-dichlorophenyl)-N-methylethane-1,2-diamine
CID 94343262
N-(4-bromophenyl)-1-(2,3-dichlorophenyl)ethane-1,2-diamine
CID 65385758
N-(2-fluorophenyl)-1-(4-propan-2-ylphenyl)ethane-1,2-diamine
CID 65378148
N-(2-bromophenyl)-1-(2-chlorophenyl)ethane-1,2-diamine
CID 65383000
1-(2,3-difluorophenyl)-N-(2-methylphenyl)ethane-1,2-diamine
CID 65378631
N-(2-chlorophenyl)-1-(2,3-dimethylphenyl)ethane-1,2-diamine
CID 65376884
1-(3-bromo-4-chlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine
CID 83230125
1-(3-chloro-2-fluorophenyl)-N-(2-fluoro-5-methoxyphenyl)ethane-1,2-diamine
CID 114488001

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine?
The IUPAC name of 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine (CID 65378776) is 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine.
What is the SMILES notation for 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine?
The canonical SMILES for 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine is NCC(Nc1ccccc1F)c1cccc(Cl)c1Cl.
What is the InChIKey of 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine?
The InChIKey is FIOJMEGJXWVEHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2FN2/c15-10-5-3-4-9(14(10)16)13(8-18)19-12-7-2-1-6-11(12)17/h1-7,13,19H,8,18H2.
What are the key properties of 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine?
1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine has a molecular weight of 299.18 g/mol, XLogP of 4.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)-N-(2-fluorophenyl)ethane-1,2-diamine is sourced from PubChem (CID 65378776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).