N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine

C10H15FN2 — CID 28772410

IUPACN'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine
SMILESCCN(CCN)c1ccc(F)cc1
InChIInChI=1S/C10H15FN2/c1-2-13(8-7-12)10-5-3-9(11)4-6-10/h3-6H,2,7-8,12H2,1H3
InChIKeyCCUYGHOZHMVWSY-UHFFFAOYSA-N
MW182.24 g/mol
LogP1.61
Rot. Bonds4

About N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine

N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine (PubChem CID 28772410) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine
PubChem CID28772410
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC NameN'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine
SMILESCCN(CCN)c1ccc(F)cc1
InChIInChI=1S/C10H15FN2/c1-2-13(8-7-12)10-5-3-9(11)4-6-10/h3-6H,2,7-8,12H2,1H3
InChIKeyCCUYGHOZHMVWSY-UHFFFAOYSA-N
XLogP1.61
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-ethyl-N'-(4-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

N,N-diethyl-4-fluoroaniline
CID 592416
N'-ethyl-N'-(4-fluorophenyl)-2-methylbutane-1,4-diamine
CID 81080487
N'-ethyl-N'-(4-propan-2-ylphenyl)ethane-1,2-diamine
CID 28772434
N'-(4-ethoxyphenyl)-N'-ethylethane-1,2-diamine
CID 28772430
N'-(4-fluorophenyl)-N'-[(4-methylphenyl)methyl]ethane-1,2-diamine
CID 28771619
ethane;N-ethyl-4-fluoro-N-(phosphanylmethyl)aniline
CID 143503842
N-(9-bromononyl)-N-ethyl-4-fluoroaniline
CID 105343736
N'-(4-fluorophenyl)-N'-pentylpropane-1,3-diamine
CID 43136264
6-(N-ethyl-4-fluoroanilino)hexan-1-ol
CID 103738482
3-(aminomethyl)-6-(N-ethyl-4-fluoroanilino)hexan-3-ol
CID 106811339
N-[2-(N-ethyl-4-fluoroanilino)ethyl]-N',N'-dimethylethane-1,2-diamine
CID 62554048
N'-(4-fluorophenyl)-N'-hexylpropane-1,3-diamine
CID 43136281

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine?
The IUPAC name of N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine (CID 28772410) is N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine?
The canonical SMILES for N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine is CCN(CCN)c1ccc(F)cc1.
What is the InChIKey of N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine?
The InChIKey is CCUYGHOZHMVWSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-2-13(8-7-12)10-5-3-9(11)4-6-10/h3-6H,2,7-8,12H2,1H3.
What are the key properties of N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine?
N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine has a molecular weight of 182.24 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-(4-fluorophenyl)ethane-1,2-diamine is sourced from PubChem (CID 28772410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).