3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine

C7H11FN2 — CID 67991612

IUPAC3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine
SMILESCN(C)C1=NCC(F)C=C1
InChIInChI=1S/C7H11FN2/c1-10(2)7-4-3-6(8)5-9-7/h3-4,6H,5H2,1-2H3
InChIKeyJTYYUFNYOVBQNS-UHFFFAOYSA-N
MW142.18 g/mol
LogP0.85
Rot. Bonds

About 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine

3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine (PubChem CID 67991612) has the molecular formula C7H11FN2 and a molecular weight of 142.18 g/mol. Its IUPAC name is 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine.

Molecular Properties

Compound Name3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine
PubChem CID67991612
Molecular FormulaC7H11FN2
Molecular Weight142.18 g/mol
Exact Mass142.09
IUPAC Name3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine
SMILESCN(C)C1=NCC(F)C=C1
InChIInChI=1S/C7H11FN2/c1-10(2)7-4-3-6(8)5-9-7/h3-4,6H,5H2,1-2H3
InChIKeyJTYYUFNYOVBQNS-UHFFFAOYSA-N
XLogP0.85
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.18
LogP ≤ 50.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine?
The IUPAC name of 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine (CID 67991612) is 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine.
What is the SMILES notation for 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine?
The canonical SMILES for 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine is CN(C)C1=NCC(F)C=C1.
What is the InChIKey of 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine?
The InChIKey is JTYYUFNYOVBQNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FN2/c1-10(2)7-4-3-6(8)5-9-7/h3-4,6H,5H2,1-2H3.
What are the key properties of 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine?
3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine has a molecular weight of 142.18 g/mol, XLogP of 0.85, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N,N-dimethyl-2,3-dihydropyridin-6-amine is sourced from PubChem (CID 67991612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).