1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine

C10H14ClFN2 — CID 62066046

IUPAC1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine
SMILESCCNC(CN)c1c(F)cccc1Cl
InChIInChI=1S/C10H14ClFN2/c1-2-14-9(6-13)10-7(11)4-3-5-8(10)12/h3-5,9,14H,2,6,13H2,1H3
InChIKeyCVXKCTHMOMHGQO-UHFFFAOYSA-N
MW216.69 g/mol
LogP2.09
Rot. Bonds4

About 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine

1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine (PubChem CID 62066046) has the molecular formula C10H14ClFN2 and a molecular weight of 216.69 g/mol. Its IUPAC name is 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine.

Molecular Properties

Compound Name1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine
PubChem CID62066046
Molecular FormulaC10H14ClFN2
Molecular Weight216.69 g/mol
Exact Mass216.08
IUPAC Name1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine
SMILESCCNC(CN)c1c(F)cccc1Cl
InChIInChI=1S/C10H14ClFN2/c1-2-14-9(6-13)10-7(11)4-3-5-8(10)12/h3-5,9,14H,2,6,13H2,1H3
InChIKeyCVXKCTHMOMHGQO-UHFFFAOYSA-N
XLogP2.09
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.69
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2-chloro-6-fluorophenyl)-N-ethylethane-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-methylprop-2-enyl)ethane-1,2-diamine
CID 114616201
3-[[2-amino-1-(2-chloro-6-fluorophenyl)ethyl]amino]propan-1-ol
CID 65377412
1-(2-chloro-6-methoxyphenyl)-N-ethylethane-1,2-diamine
CID 104816313
1-(2-chloro-6-fluorophenyl)-N-ethylhex-4-yn-1-amine
CID 105037136
1-(2-chloro-6-fluorophenyl)-N-(2-chlorophenyl)ethane-1,2-diamine
CID 65378133
1-(2-chloro-6-fluorophenyl)-2-cyclobutyl-N-ethylethanamine
CID 115863424
1-(2-chloro-6-fluorophenyl)-2-(2,4-dichlorophenyl)-N-ethylethanamine
CID 115839919
1-(2-chloro-6-fluorophenyl)-N-(3-chlorophenyl)ethane-1,2-diamine
CID 65384020
3-[[2-amino-1-(2-chloro-6-fluorophenyl)ethyl]amino]-2-methylbutan-1-ol
CID 113484777
1-(2-chloro-6-fluorophenyl)-N-ethyl-2-(3-methoxyphenyl)ethanamine
CID 61066458
N-(4-bromo-3,5-dimethylphenyl)-1-(2-chloro-6-fluorophenyl)ethane-1,2-diamine
CID 107573239
1-(2-chloro-6-fluorophenyl)-N-ethyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 115821272

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine?
The IUPAC name of 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine (CID 62066046) is 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine.
What is the SMILES notation for 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine?
The canonical SMILES for 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine is CCNC(CN)c1c(F)cccc1Cl.
What is the InChIKey of 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine?
The InChIKey is CVXKCTHMOMHGQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClFN2/c1-2-14-9(6-13)10-7(11)4-3-5-8(10)12/h3-5,9,14H,2,6,13H2,1H3.
What are the key properties of 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine?
1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine has a molecular weight of 216.69 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine is sourced from PubChem (CID 62066046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).