5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine

C11H18FN3 — CID 139390472

IUPAC5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine
SMILESCN1CCC(N2C=C(F)C=C(N)C2)CC1
InChIInChI=1S/C11H18FN3/c1-14-4-2-11(3-5-14)15-7-9(12)6-10(13)8-15/h6-7,11H,2-5,8,13H2,1H3
InChIKeyBXPSKTQJHZUUFI-UHFFFAOYSA-N
MW211.28 g/mol
LogP1.05
Rot. Bonds1

About 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine

5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine (PubChem CID 139390472) has the molecular formula C11H18FN3 and a molecular weight of 211.28 g/mol. Its IUPAC name is 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine.

Molecular Properties

Compound Name5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine
PubChem CID139390472
Molecular FormulaC11H18FN3
Molecular Weight211.28 g/mol
Exact Mass211.15
IUPAC Name5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine
SMILESCN1CCC(N2C=C(F)C=C(N)C2)CC1
InChIInChI=1S/C11H18FN3/c1-14-4-2-11(3-5-14)15-7-9(12)6-10(13)8-15/h6-7,11H,2-5,8,13H2,1H3
InChIKeyBXPSKTQJHZUUFI-UHFFFAOYSA-N
XLogP1.05
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.28
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3R)-3-fluoro-1-methylpiperidin-4-yl]-2H-pyridin-3-amine
CID 137449696
1-[1-(2-fluoroethyl)piperidin-3-yl]-2H-pyridin-3-amine
CID 139373459
1-[(3S)-3-fluoro-1-methylpiperidin-4-yl]-2H-pyridin-3-amine
CID 139383769
1-[1-(2-fluoroethyl)piperidin-4-yl]-2H-pyridin-3-amine
CID 139383870
(3E)-4-fluoro-5-piperidin-1-ylhexa-1,3,5-trien-2-amine
CID 143599145
1-[3-(Dimethylamino)prop-1-en-2-yl]-3-fluoropiperidin-4-amine
CID 171530885
4-(5-Fluoro-1,2-dihydropyridin-4-yl)-1,2-dimethylpiperazine
CID 174194419
3-fluoro-1-piperidin-4-yl-2H-pyridine
CID 174866402
1-[3-(dimethylamino)prop-1-en-2-yl]-3-fluoro-N-methylpiperidin-4-amine
CID 176992197
1-piperidin-4-yl-2H-pyridin-4-amine
CID 19068126
[1-[(1-methylpiperidin-2-yl)methyl]-2H-pyridin-6-yl]methanamine
CID 68931925
(1E,3Z)-2-[4-(dimethylamino)piperidin-1-yl]hexa-1,3,5-triene-1,5-diamine
CID 87688619

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine?
The IUPAC name of 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine (CID 139390472) is 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine.
What is the SMILES notation for 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine?
The canonical SMILES for 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine is CN1CCC(N2C=C(F)C=C(N)C2)CC1.
What is the InChIKey of 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine?
The InChIKey is BXPSKTQJHZUUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FN3/c1-14-4-2-11(3-5-14)15-7-9(12)6-10(13)8-15/h6-7,11H,2-5,8,13H2,1H3.
What are the key properties of 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine?
5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine has a molecular weight of 211.28 g/mol, XLogP of 1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine is sourced from PubChem (CID 139390472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).