1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol

C11H15FN2O — CID 65111028

IUPAC1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol
SMILESOC1(CNc2ccc(F)cn2)CCCC1
InChIInChI=1S/C11H15FN2O/c12-9-3-4-10(13-7-9)14-8-11(15)5-1-2-6-11/h3-4,7,15H,1-2,5-6,8H2,(H,13,14)
InChIKeyIIIKYWKRMRGRDG-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.94
Rot. Bonds3

About 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol

1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol (PubChem CID 65111028) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol
PubChem CID65111028
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol
SMILESOC1(CNc2ccc(F)cn2)CCCC1
InChIInChI=1S/C11H15FN2O/c12-9-3-4-10(13-7-9)14-8-11(15)5-1-2-6-11/h3-4,7,15H,1-2,5-6,8H2,(H,13,14)
InChIKeyIIIKYWKRMRGRDG-UHFFFAOYSA-N
XLogP1.94
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol (CID 65111028) is 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol is OC1(CNc2ccc(F)cn2)CCCC1.
What is the InChIKey of 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is IIIKYWKRMRGRDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c12-9-3-4-10(13-7-9)14-8-11(15)5-1-2-6-11/h3-4,7,15H,1-2,5-6,8H2,(H,13,14).
What are the key properties of 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 210.25 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(5-fluoro-2-pyridinyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65111028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).