(3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol

C15H21FN2O2 — CID 104738059

IUPAC(3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol
SMILESOC(c1ccncc1F)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C15H21FN2O2/c16-13-11-17-6-3-12(13)14(19)15(4-1-2-5-15)18-7-9-20-10-8-18/h3,6,11,14,19H,1-2,4-5,7-10H2
InChIKeyBFLCQVRQQGLKTK-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.90
Rot. Bonds3

About (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol

(3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol (PubChem CID 104738059) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol.

Molecular Properties

Compound Name(3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol
PubChem CID104738059
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name(3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol
SMILESOC(c1ccncc1F)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C15H21FN2O2/c16-13-11-17-6-3-12(13)14(19)15(4-1-2-5-15)18-7-9-20-10-8-18/h3,6,11,14,19H,1-2,4-5,7-10H2
InChIKeyBFLCQVRQQGLKTK-UHFFFAOYSA-N
XLogP1.90
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol?
The IUPAC name of (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol (CID 104738059) is (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol.
What is the SMILES notation for (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol?
The canonical SMILES for (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol is OC(c1ccncc1F)C1(N2CCOCC2)CCCC1.
What is the InChIKey of (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol?
The InChIKey is BFLCQVRQQGLKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c16-13-11-17-6-3-12(13)14(19)15(4-1-2-5-15)18-7-9-20-10-8-18/h3,6,11,14,19H,1-2,4-5,7-10H2.
What are the key properties of (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol?
(3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol has a molecular weight of 280.34 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-pyridinyl)-(1-morpholin-4-ylcyclopentyl)methanol is sourced from PubChem (CID 104738059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).