N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine

C6H15FN2 — CID 81106784

IUPACN'-(3-fluoropropyl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)CCCF
InChIInChI=1S/C6H15FN2/c1-9(6-4-8)5-2-3-7/h2-6,8H2,1H3
InChIKeyGLQRNQSYHZKZSN-UHFFFAOYSA-N
MW134.20 g/mol
LogP0.24
Rot. Bonds5

About N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine

N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine (PubChem CID 81106784) has the molecular formula C6H15FN2 and a molecular weight of 134.20 g/mol. Its IUPAC name is N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(3-fluoropropyl)-N'-methylethane-1,2-diamine
PubChem CID81106784
Molecular FormulaC6H15FN2
Molecular Weight134.20 g/mol
Exact Mass134.12
IUPAC NameN'-(3-fluoropropyl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)CCCF
InChIInChI=1S/C6H15FN2/c1-9(6-4-8)5-2-3-7/h2-6,8H2,1H3
InChIKeyGLQRNQSYHZKZSN-UHFFFAOYSA-N
XLogP0.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.20
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-(3-fluoropropyl)-N'-methylethane-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

Frequently Asked Questions

What is the IUPAC name of N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine (CID 81106784) is N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine is CN(CCN)CCCF.
What is the InChIKey of N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine?
The InChIKey is GLQRNQSYHZKZSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15FN2/c1-9(6-4-8)5-2-3-7/h2-6,8H2,1H3.
What are the key properties of N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine?
N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine has a molecular weight of 134.20 g/mol, XLogP of 0.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-fluoropropyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 81106784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).