N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine

C11H17FN2 — CID 175752514

IUPACN-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCCc1ccc(F)cn1
InChIInChI=1S/C11H17FN2/c1-11(2,3)14-7-6-10-5-4-9(12)8-13-10/h4-5,8,14H,6-7H2,1-3H3
InChIKeyIZUFVMBKHBNRKF-UHFFFAOYSA-N
MW196.27 g/mol
LogP2.15
Rot. Bonds3

About N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine

N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine (PubChem CID 175752514) has the molecular formula C11H17FN2 and a molecular weight of 196.27 g/mol. Its IUPAC name is N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine
PubChem CID175752514
Molecular FormulaC11H17FN2
Molecular Weight196.27 g/mol
Exact Mass196.14
IUPAC NameN-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCCc1ccc(F)cn1
InChIInChI=1S/C11H17FN2/c1-11(2,3)14-7-6-10-5-4-9(12)8-13-10/h4-5,8,14H,6-7H2,1-3H3
InChIKeyIZUFVMBKHBNRKF-UHFFFAOYSA-N
XLogP2.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine?
The IUPAC name of N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine (CID 175752514) is N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine is CC(C)(C)NCCc1ccc(F)cn1.
What is the InChIKey of N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine?
The InChIKey is IZUFVMBKHBNRKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2/c1-11(2,3)14-7-6-10-5-4-9(12)8-13-10/h4-5,8,14H,6-7H2,1-3H3.
What are the key properties of N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine?
N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine has a molecular weight of 196.27 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-fluoro-2-pyridinyl)ethyl]-2-methylpropan-2-amine is sourced from PubChem (CID 175752514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).