5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine

C9H19FN4 — CID 130280088

IUPAC5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine
SMILESCN1CNCC1C1C(N)CNCC1F
InChIInChI=1S/C9H19FN4/c1-14-5-13-4-8(14)9-6(10)2-12-3-7(9)11/h6-9,12-13H,2-5,11H2,1H3
InChIKeyFYJFVARCAABHPV-UHFFFAOYSA-N
MW202.28 g/mol
LogP-1.27
Rot. Bonds1

About 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine

5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine (PubChem CID 130280088) has the molecular formula C9H19FN4 and a molecular weight of 202.28 g/mol. Its IUPAC name is 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine.

Molecular Properties

Compound Name5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine
PubChem CID130280088
Molecular FormulaC9H19FN4
Molecular Weight202.28 g/mol
Exact Mass202.16
IUPAC Name5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine
SMILESCN1CNCC1C1C(N)CNCC1F
InChIInChI=1S/C9H19FN4/c1-14-5-13-4-8(14)9-6(10)2-12-3-7(9)11/h6-9,12-13H,2-5,11H2,1H3
InChIKeyFYJFVARCAABHPV-UHFFFAOYSA-N
XLogP-1.27
TPSA53.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 5-1.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-Ethyl-2-fluoro-2-pyrrolidin-1-ylpiperidin-3-amine
CID 68152150
1-Ethyl-2-(2-fluoropyrrolidin-1-yl)piperidin-3-amine
CID 68152152
3-Fluoro-2,7-dimethyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
CID 89687897
2-(Aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine
CID 122675191
5-Fluoro-4-(4-imidazolidin-1-ylpiperidin-1-yl)piperidin-3-amine
CID 123467513
4-[2-(Trifluoromethyl)imidazolidin-1-yl]piperidin-3-amine
CID 123468059
3-Fluoro-7-methyl-2-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
CID 130205318
3-Cyclohexyl-5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine
CID 138645869
3-Fluoro-2-propan-2-yl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,2-a]pyridine
CID 140642496
1-[[(2R,3S,4R)-4-fluoro-2-methyl-1-propan-2-ylpyrrolidin-3-yl]methyl]piperazine
CID 149156472
1-[[(2R,4R)-1-tert-butyl-4-fluoro-2-methylpyrrolidin-3-yl]methyl]piperazine
CID 153298849
1-[[(2R,3S,4R)-1-tert-butyl-4-fluoro-2-methylpyrrolidin-3-yl]methyl]piperazine
CID 153298859

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine?
The IUPAC name of 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine (CID 130280088) is 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine.
What is the SMILES notation for 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine?
The canonical SMILES for 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine is CN1CNCC1C1C(N)CNCC1F.
What is the InChIKey of 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine?
The InChIKey is FYJFVARCAABHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FN4/c1-14-5-13-4-8(14)9-6(10)2-12-3-7(9)11/h6-9,12-13H,2-5,11H2,1H3.
What are the key properties of 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine?
5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine has a molecular weight of 202.28 g/mol, XLogP of -1.27, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine is sourced from PubChem (CID 130280088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).