(3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol

C10H20FNO — CID 176977090

IUPAC(3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol
SMILESCC(C)CN1CC[C@@](C)(O)[C@H](F)C1
InChIInChI=1S/C10H20FNO/c1-8(2)6-12-5-4-10(3,13)9(11)7-12/h8-9,13H,4-7H2,1-3H3/t9-,10-/m1/s1
InChIKeyFZXDNTWGPUIPMS-NXEZZACHSA-N
MW189.27 g/mol
LogP1.44
Rot. Bonds2

About (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol

(3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol (PubChem CID 176977090) has the molecular formula C10H20FNO and a molecular weight of 189.27 g/mol. Its IUPAC name is (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol.

Molecular Properties

Compound Name(3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol
PubChem CID176977090
Molecular FormulaC10H20FNO
Molecular Weight189.27 g/mol
Exact Mass189.15
IUPAC Name(3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol
SMILESCC(C)CN1CC[C@@](C)(O)[C@H](F)C1
InChIInChI=1S/C10H20FNO/c1-8(2)6-12-5-4-10(3,13)9(11)7-12/h8-9,13H,4-7H2,1-3H3/t9-,10-/m1/s1
InChIKeyFZXDNTWGPUIPMS-NXEZZACHSA-N
XLogP1.44
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.27
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,4R)-3-fluoro-1-(2-methylpropyl)piperidin-4-ol
CID 176977042
4-(methoxymethyl)-1-(2-methylpropyl)piperidin-4-ol
CID 103857787
(3S)-3-fluoro-1-(2-methylpropyl)piperidine
CID 130368506
4-methyl-1,4-bis(2-methylpropyl)piperidine
CID 176612276
CID 174109893
CID 174109893
1-(3-fluorobutyl)-4-methylpiperidin-4-ol
CID 131089129
[4-(2-methylpropyl)piperazin-1-yl]methanol
CID 58575664
(3R)-1-(2-methylpropyl)azepan-3-ol
CID 171752832
2,8-bis(2-methylpropyl)-2,8-diazaspiro[4.5]decane
CID 129193421
(3S,4S)-3-fluoro-3-methyl-1-(2-methylpropyl)piperidin-4-ol
CID 176977070
4,4-diethyl-1-(2-methylpropyl)piperidine;ethane
CID 154670691
1-(2-hydroxypropyl)-4-methylpiperidin-4-ol
CID 81103491

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol?
The IUPAC name of (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol (CID 176977090) is (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol.
What is the SMILES notation for (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol?
The canonical SMILES for (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol is CC(C)CN1CC[C@@](C)(O)[C@H](F)C1.
What is the InChIKey of (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol?
The InChIKey is FZXDNTWGPUIPMS-NXEZZACHSA-N. The full InChI is InChI=1S/C10H20FNO/c1-8(2)6-12-5-4-10(3,13)9(11)7-12/h8-9,13H,4-7H2,1-3H3/t9-,10-/m1/s1.
What are the key properties of (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol?
(3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol has a molecular weight of 189.27 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-3-fluoro-4-methyl-1-(2-methylpropyl)piperidin-4-ol is sourced from PubChem (CID 176977090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).