N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine

C14H20FN3 — CID 55090808

IUPACN-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine
SMILESFc1ccc(N2CCC(CNC3CC3)CC2)nc1
InChIInChI=1S/C14H20FN3/c15-12-1-4-14(17-10-12)18-7-5-11(6-8-18)9-16-13-2-3-13/h1,4,10-11,13,16H,2-3,5-9H2
InChIKeyCOHWGCKJVRADLJ-UHFFFAOYSA-N
MW249.33 g/mol
LogP2.19
Rot. Bonds4

About N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine

N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine (PubChem CID 55090808) has the molecular formula C14H20FN3 and a molecular weight of 249.33 g/mol. Its IUPAC name is N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine
PubChem CID55090808
Molecular FormulaC14H20FN3
Molecular Weight249.33 g/mol
Exact Mass249.16
IUPAC NameN-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine
SMILESFc1ccc(N2CCC(CNC3CC3)CC2)nc1
InChIInChI=1S/C14H20FN3/c15-12-1-4-14(17-10-12)18-7-5-11(6-8-18)9-16-13-2-3-13/h1,4,10-11,13,16H,2-3,5-9H2
InChIKeyCOHWGCKJVRADLJ-UHFFFAOYSA-N
XLogP2.19
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]methyl]cyclopropanamine
CID 62592662
2-[4-(bromomethyl)piperidin-1-yl]-5-fluoropyridine
CID 80668710
N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]cyclopropanamine
CID 62592661
2-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methoxy]-5-piperazin-1-ylpyrazine
CID 143780648
4-chloro-1-(5-fluoro-2-pyridinyl)azepane
CID 131020139
1-[1-(5-fluoro-2-pyridinyl)piperidin-3-yl]-N-methylmethanamine
CID 61313343
(1R)-1-[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]ethanol
CID 100670630
1-(5-fluoro-2-pyridinyl)azetidin-3-amine
CID 63759054
N-(cyclopropylmethyl)-6-piperidin-1-ylpyridin-3-amine
CID 43690356
N-(cyclopropylmethyl)-1-pyrido[2,3-b]pyrazin-6-ylpiperidin-4-amine
CID 115307509
N-[[1-(5-fluoro-2-methylphenyl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 55081383
N-(cyclopropylmethyl)-1-(5,6-dimethylpyrazin-2-yl)piperidin-4-amine
CID 114476593

Frequently Asked Questions

What is the IUPAC name of N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine (CID 55090808) is N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine is Fc1ccc(N2CCC(CNC3CC3)CC2)nc1.
What is the InChIKey of N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine?
The InChIKey is COHWGCKJVRADLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3/c15-12-1-4-14(17-10-12)18-7-5-11(6-8-18)9-16-13-2-3-13/h1,4,10-11,13,16H,2-3,5-9H2.
What are the key properties of N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine?
N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine has a molecular weight of 249.33 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(5-fluoro-2-pyridinyl)piperidin-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 55090808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).