N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine

C11H17FN2 — CID 43374430

IUPACN'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)Cc1ccccc1F
InChIInChI=1S/C11H17FN2/c1-13-7-8-14(2)9-10-5-3-4-6-11(10)12/h3-6,13H,7-9H2,1-2H3
InChIKeyBCGLMGRQGUJVCX-UHFFFAOYSA-N
MW196.27 g/mol
LogP1.48
Rot. Bonds5

About N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine

N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine (PubChem CID 43374430) has the molecular formula C11H17FN2 and a molecular weight of 196.27 g/mol. Its IUPAC name is N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
PubChem CID43374430
Molecular FormulaC11H17FN2
Molecular Weight196.27 g/mol
Exact Mass196.14
IUPAC NameN'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)Cc1ccccc1F
InChIInChI=1S/C11H17FN2/c1-13-7-8-14(2)9-10-5-3-4-6-11(10)12/h3-6,13H,7-9H2,1-2H3
InChIKeyBCGLMGRQGUJVCX-UHFFFAOYSA-N
XLogP1.48
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-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'-[(2-chlorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
CID 43374414
N'-[(5-bromo-2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine
CID 43374438
N-(2-chlorophenyl)-N'-[(2-fluorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 62556464
N-(3-fluorophenyl)-N'-[(2-fluorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 62557336
3-[(2-fluorophenyl)methyl-methylamino]propan-1-ol
CID 60674294
3-chloro-N-[(2-fluorophenyl)methyl]-N-methylpropan-1-amine
CID 61412579
N',N'-diethyl-N-[(2-fluorophenyl)methyl]-N-methylethane-1,2-diamine
CID 783899
N'-[(2-fluorophenyl)methyl]-N'-methyl-N-propan-2-ylbutane-1,4-diamine
CID 61412231
3-[(2-fluorophenyl)methyl-methylamino]propanamide
CID 60647903
N'-[(2-fluorophenyl)methyl]-N'-methyl-N-(2-methylpropyl)butane-1,4-diamine
CID 62435902
2-azido-N-[(2-fluorophenyl)methyl]-N-methylethanamine
CID 61412793
N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide
CID 24588973

Frequently Asked Questions

What is the IUPAC name of N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine?
The IUPAC name of N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine (CID 43374430) is N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine?
The canonical SMILES for N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine is CNCCN(C)Cc1ccccc1F.
What is the InChIKey of N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine?
The InChIKey is BCGLMGRQGUJVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2/c1-13-7-8-14(2)9-10-5-3-4-6-11(10)12/h3-6,13H,7-9H2,1-2H3.
What are the key properties of N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine?
N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine has a molecular weight of 196.27 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2-fluorophenyl)methyl]-N,N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 43374430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).