1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine

C11H23FN2 — CID 174246094

IUPAC1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine
SMILESCC(C)C1CCN(C(C)N)C[C@]1(C)F
InChIInChI=1S/C11H23FN2/c1-8(2)10-5-6-14(9(3)13)7-11(10,4)12/h8-10H,5-7,13H2,1-4H3/t9?,10?,11-/m0/s1
InChIKeySWHKVEWGLRGQLU-ILDUYXDCSA-N
MW202.32 g/mol
LogP2.00
Rot. Bonds2

About 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine

1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine (PubChem CID 174246094) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine.

Molecular Properties

Compound Name1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine
PubChem CID174246094
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Name1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine
SMILESCC(C)C1CCN(C(C)N)C[C@]1(C)F
InChIInChI=1S/C11H23FN2/c1-8(2)10-5-6-14(9(3)13)7-11(10,4)12/h8-10H,5-7,13H2,1-4H3/t9?,10?,11-/m0/s1
InChIKeySWHKVEWGLRGQLU-ILDUYXDCSA-N
XLogP2.00
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine?
The IUPAC name of 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine (CID 174246094) is 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine.
What is the SMILES notation for 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine?
The canonical SMILES for 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine is CC(C)C1CCN(C(C)N)C[C@]1(C)F.
What is the InChIKey of 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine?
The InChIKey is SWHKVEWGLRGQLU-ILDUYXDCSA-N. The full InChI is InChI=1S/C11H23FN2/c1-8(2)10-5-6-14(9(3)13)7-11(10,4)12/h8-10H,5-7,13H2,1-4H3/t9?,10?,11-/m0/s1.
What are the key properties of 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine?
1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine has a molecular weight of 202.32 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-3-fluoro-3-methyl-4-propan-2-ylpiperidin-1-yl]ethanamine is sourced from PubChem (CID 174246094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).