N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine

C11H23FN2 — CID 59363457

IUPACN-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine
SMILESCC(CF)NC1CCN(C(C)C)CC1
InChIInChI=1S/C11H23FN2/c1-9(2)14-6-4-11(5-7-14)13-10(3)8-12/h9-11,13H,4-8H2,1-3H3
InChIKeyHLKPQNCSYYJMIP-UHFFFAOYSA-N
MW202.32 g/mol
LogP1.81
Rot. Bonds4

About N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine

N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine (PubChem CID 59363457) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine
PubChem CID59363457
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC NameN-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine
SMILESCC(CF)NC1CCN(C(C)C)CC1
InChIInChI=1S/C11H23FN2/c1-9(2)14-6-4-11(5-7-14)13-10(3)8-12/h9-11,13H,4-8H2,1-3H3
InChIKeyHLKPQNCSYYJMIP-UHFFFAOYSA-N
XLogP1.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine (CID 59363457) is N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine is CC(CF)NC1CCN(C(C)C)CC1.
What is the InChIKey of N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine?
The InChIKey is HLKPQNCSYYJMIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FN2/c1-9(2)14-6-4-11(5-7-14)13-10(3)8-12/h9-11,13H,4-8H2,1-3H3.
What are the key properties of N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine?
N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine has a molecular weight of 202.32 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-fluoropropan-2-yl)-1-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 59363457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).