[1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol

C11H18FNO — CID 171798845

IUPAC[1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol
SMILESOCC1(CN2CCC(=CF)CC2)CC1
InChIInChI=1S/C11H18FNO/c12-7-10-1-5-13(6-2-10)8-11(9-14)3-4-11/h7,14H,1-6,8-9H2
InChIKeyPBKKGXBNRJKHNC-UHFFFAOYSA-N
MW199.27 g/mol
LogP1.71
Rot. Bonds3

About [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol

[1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol (PubChem CID 171798845) has the molecular formula C11H18FNO and a molecular weight of 199.27 g/mol. Its IUPAC name is [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol
PubChem CID171798845
Molecular FormulaC11H18FNO
Molecular Weight199.27 g/mol
Exact Mass199.14
IUPAC Name[1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol
SMILESOCC1(CN2CCC(=CF)CC2)CC1
InChIInChI=1S/C11H18FNO/c12-7-10-1-5-13(6-2-10)8-11(9-14)3-4-11/h7,14H,1-6,8-9H2
InChIKeyPBKKGXBNRJKHNC-UHFFFAOYSA-N
XLogP1.71
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.27
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol (CID 171798845) is [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol is OCC1(CN2CCC(=CF)CC2)CC1.
What is the InChIKey of [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol?
The InChIKey is PBKKGXBNRJKHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FNO/c12-7-10-1-5-13(6-2-10)8-11(9-14)3-4-11/h7,14H,1-6,8-9H2.
What are the key properties of [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol?
[1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol has a molecular weight of 199.27 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[4-(fluoromethylidene)piperidin-1-yl]methyl]cyclopropyl]methanol is sourced from PubChem (CID 171798845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).