N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine

C14H15FN2O2 — CID 105390784

IUPACN-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine
SMILESFc1c(CNC2CC2)ccnc1OCc1ccco1
InChIInChI=1S/C14H15FN2O2/c15-13-10(8-17-11-3-4-11)5-6-16-14(13)19-9-12-2-1-7-18-12/h1-2,5-7,11,17H,3-4,8-9H2
InChIKeyMLLYYFZAHLAJPA-UHFFFAOYSA-N
MW262.28 g/mol
LogP2.64
Rot. Bonds6

About N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine

N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine (PubChem CID 105390784) has the molecular formula C14H15FN2O2 and a molecular weight of 262.28 g/mol. Its IUPAC name is N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine
PubChem CID105390784
Molecular FormulaC14H15FN2O2
Molecular Weight262.28 g/mol
Exact Mass262.11
IUPAC NameN-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine
SMILESFc1c(CNC2CC2)ccnc1OCc1ccco1
InChIInChI=1S/C14H15FN2O2/c15-13-10(8-17-11-3-4-11)5-6-16-14(13)19-9-12-2-1-7-18-12/h1-2,5-7,11,17H,3-4,8-9H2
InChIKeyMLLYYFZAHLAJPA-UHFFFAOYSA-N
XLogP2.64
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine (CID 105390784) is N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine is Fc1c(CNC2CC2)ccnc1OCc1ccco1.
What is the InChIKey of N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine?
The InChIKey is MLLYYFZAHLAJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O2/c15-13-10(8-17-11-3-4-11)5-6-16-14(13)19-9-12-2-1-7-18-12/h1-2,5-7,11,17H,3-4,8-9H2.
What are the key properties of N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine?
N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine has a molecular weight of 262.28 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-fluoro-2-(furan-2-ylmethoxy)-4-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 105390784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).