(1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol

C11H20FNO — CID 177009289

IUPAC(1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol
SMILESC[C@H](O)C1(CN2CCC(F)CC2)CC1
InChIInChI=1S/C11H20FNO/c1-9(14)11(4-5-11)8-13-6-2-10(12)3-7-13/h9-10,14H,2-8H2,1H3/t9-/m0/s1
InChIKeyLDDLBRWDWNCNKG-VIFPVBQESA-N
MW201.28 g/mol
LogP1.58
Rot. Bonds3

About (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol

(1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol (PubChem CID 177009289) has the molecular formula C11H20FNO and a molecular weight of 201.28 g/mol. Its IUPAC name is (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol
PubChem CID177009289
Molecular FormulaC11H20FNO
Molecular Weight201.28 g/mol
Exact Mass201.15
IUPAC Name(1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol
SMILESC[C@H](O)C1(CN2CCC(F)CC2)CC1
InChIInChI=1S/C11H20FNO/c1-9(14)11(4-5-11)8-13-6-2-10(12)3-7-13/h9-10,14H,2-8H2,1H3/t9-/m0/s1
InChIKeyLDDLBRWDWNCNKG-VIFPVBQESA-N
XLogP1.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.28
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol?
The IUPAC name of (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol (CID 177009289) is (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol.
What is the SMILES notation for (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol?
The canonical SMILES for (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol is C[C@H](O)C1(CN2CCC(F)CC2)CC1.
What is the InChIKey of (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol?
The InChIKey is LDDLBRWDWNCNKG-VIFPVBQESA-N. The full InChI is InChI=1S/C11H20FNO/c1-9(14)11(4-5-11)8-13-6-2-10(12)3-7-13/h9-10,14H,2-8H2,1H3/t9-/m0/s1.
What are the key properties of (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol?
(1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol has a molecular weight of 201.28 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[1-[(4-fluoropiperidin-1-yl)methyl]cyclopropyl]ethanol is sourced from PubChem (CID 177009289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).