N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine

C11H18FN3O — CID 155407869

IUPACN-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine
SMILESFCCN(Cc1cnco1)C1CCNCC1
InChIInChI=1S/C11H18FN3O/c12-3-6-15(8-11-7-14-9-16-11)10-1-4-13-5-2-10/h7,9-10,13H,1-6,8H2
InChIKeyOZVSLBNUKPEKHS-UHFFFAOYSA-N
MW227.28 g/mol
LogP1.20
Rot. Bonds5

About N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine

N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine (PubChem CID 155407869) has the molecular formula C11H18FN3O and a molecular weight of 227.28 g/mol. Its IUPAC name is N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine
PubChem CID155407869
Molecular FormulaC11H18FN3O
Molecular Weight227.28 g/mol
Exact Mass227.14
IUPAC NameN-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine
SMILESFCCN(Cc1cnco1)C1CCNCC1
InChIInChI=1S/C11H18FN3O/c12-3-6-15(8-11-7-14-9-16-11)10-1-4-13-5-2-10/h7,9-10,13H,1-6,8H2
InChIKeyOZVSLBNUKPEKHS-UHFFFAOYSA-N
XLogP1.20
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.28
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine?
The IUPAC name of N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine (CID 155407869) is N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine is FCCN(Cc1cnco1)C1CCNCC1.
What is the InChIKey of N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine?
The InChIKey is OZVSLBNUKPEKHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FN3O/c12-3-6-15(8-11-7-14-9-16-11)10-1-4-13-5-2-10/h7,9-10,13H,1-6,8H2.
What are the key properties of N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine?
N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine has a molecular weight of 227.28 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-N-(1,3-oxazol-5-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 155407869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).