3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine

C13H20FN3 — CID 62734731

IUPAC3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine
SMILESCC1CCN(CCNc2ncccc2F)CC1
InChIInChI=1S/C13H20FN3/c1-11-4-8-17(9-5-11)10-7-16-13-12(14)3-2-6-15-13/h2-3,6,11H,4-5,7-10H2,1H3,(H,15,16)
InChIKeyDFTYQRQEYFFMDF-UHFFFAOYSA-N
MW237.32 g/mol
LogP2.36
Rot. Bonds4

About 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine

3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine (PubChem CID 62734731) has the molecular formula C13H20FN3 and a molecular weight of 237.32 g/mol. Its IUPAC name is 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine
PubChem CID62734731
Molecular FormulaC13H20FN3
Molecular Weight237.32 g/mol
Exact Mass237.16
IUPAC Name3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine
SMILESCC1CCN(CCNc2ncccc2F)CC1
InChIInChI=1S/C13H20FN3/c1-11-4-8-17(9-5-11)10-7-16-13-12(14)3-2-6-15-13/h2-3,6,11H,4-5,7-10H2,1H3,(H,15,16)
InChIKeyDFTYQRQEYFFMDF-UHFFFAOYSA-N
XLogP2.36
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine 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

Tripelennamine
CID 5587
Tripelennamine Hydrochloride
CID 9066
2-(Benzylamino)pyridine
CID 23362
2,2'-Dipyridylamine
CID 14547
1-(2-Pyridyl)piperazine
CID 94459
2-Pyridinamine, N-methyl-
CID 20727
2-Pyridinamine, 4-methyl-N-(phenylmethyl)-
CID 83053
2-(Piperazin-1-yl)pyridine-3-carbonitrile
CID 2737203
1-[3-(Trifluoromethyl)pyridin-2-yl]piperazine
CID 2777786
N-cyclohexyl-4-methylpyridin-2-amine
CID 2366458
1-(2-Phenethyl)-4-(2-pyridyl)piperazine
CID 11000026
N1,N1-Dimethyl-N2-2-pyridinyl-1,2-ethanediamine
CID 90273

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine?
The IUPAC name of 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine (CID 62734731) is 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine is CC1CCN(CCNc2ncccc2F)CC1.
What is the InChIKey of 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine?
The InChIKey is DFTYQRQEYFFMDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20FN3/c1-11-4-8-17(9-5-11)10-7-16-13-12(14)3-2-6-15-13/h2-3,6,11H,4-5,7-10H2,1H3,(H,15,16).
What are the key properties of 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine?
3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine has a molecular weight of 237.32 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[2-(4-methylpiperidin-1-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 62734731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).