1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine

C15H24FN3 — CID 83126206

IUPAC1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine
SMILESCNC(CCN1CCCCC1C)c1ccc(F)cn1
InChIInChI=1S/C15H24FN3/c1-12-5-3-4-9-19(12)10-8-14(17-2)15-7-6-13(16)11-18-15/h6-7,11-12,14,17H,3-5,8-10H2,1-2H3
InChIKeyFYRCORGBVCVFNB-UHFFFAOYSA-N
MW265.38 g/mol
LogP2.75
Rot. Bonds5

About 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine

1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine (PubChem CID 83126206) has the molecular formula C15H24FN3 and a molecular weight of 265.38 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine
PubChem CID83126206
Molecular FormulaC15H24FN3
Molecular Weight265.38 g/mol
Exact Mass265.20
IUPAC Name1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine
SMILESCNC(CCN1CCCCC1C)c1ccc(F)cn1
InChIInChI=1S/C15H24FN3/c1-12-5-3-4-9-19(12)10-8-14(17-2)15-7-6-13(16)11-18-15/h6-7,11-12,14,17H,3-5,8-10H2,1-2H3
InChIKeyFYRCORGBVCVFNB-UHFFFAOYSA-N
XLogP2.75
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine (CID 83126206) is 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine is CNC(CCN1CCCCC1C)c1ccc(F)cn1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine?
The InChIKey is FYRCORGBVCVFNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FN3/c1-12-5-3-4-9-19(12)10-8-14(17-2)15-7-6-13(16)11-18-15/h6-7,11-12,14,17H,3-5,8-10H2,1-2H3.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine?
1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine has a molecular weight of 265.38 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)-N-methyl-3-(2-methylpiperidin-1-yl)propan-1-amine is sourced from PubChem (CID 83126206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).