1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol

C12H24N2O — CID 156719953

IUPAC1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol
SMILESCN1CCC[C@@H](CN2CCC(O)CC2)C1
InChIInChI=1S/C12H24N2O/c1-13-6-2-3-11(9-13)10-14-7-4-12(15)5-8-14/h11-12,15H,2-10H2,1H3/t11-/m1/s1
InChIKeyBMVAYAANLOZADC-LLVKDONJSA-N
MW212.34 g/mol
LogP0.78
Rot. Bonds2

About 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol

1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol (PubChem CID 156719953) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol
PubChem CID156719953
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol
SMILESCN1CCC[C@@H](CN2CCC(O)CC2)C1
InChIInChI=1S/C12H24N2O/c1-13-6-2-3-11(9-13)10-14-7-4-12(15)5-8-14/h11-12,15H,2-10H2,1H3/t11-/m1/s1
InChIKeyBMVAYAANLOZADC-LLVKDONJSA-N
XLogP0.78
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-(pyrrolidin-1-ylmethyl)piperidine
CID 19028453
3-(azepan-1-ylmethyl)-1-methylazocane
CID 129168492
1-(cyclopropylmethyl)piperidin-4-ol
CID 21428752
ethane;1-[(1-methylpiperidin-4-yl)methyl]piperidin-4-ol;propane
CID 168901872
1,4-bis[(1-methylazetidin-3-yl)methyl]piperazine
CID 169319674
1-(cyclopentylmethyl)pyrrolidin-3-ol
CID 62916815
(4S)-1-methylazepan-4-ol
CID 29414429
ethane;1-[(1-methylpiperidin-4-yl)methyl]pyrrolidin-3-ol
CID 177318564
1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol
CID 157039193
ethane;(1-methylpiperidin-3-yl)methanol
CID 142013659
(3S)-1-[(1-methylsulfonylpiperidin-3-yl)methyl]pyrrolidin-3-ol
CID 113249309
1-(azetidin-3-ylmethyl)piperidin-4-ol;cyclohexane
CID 157039213

Frequently Asked Questions

What is the IUPAC name of 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol?
The IUPAC name of 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol (CID 156719953) is 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol.
What is the SMILES notation for 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol?
The canonical SMILES for 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol is CN1CCC[C@@H](CN2CCC(O)CC2)C1.
What is the InChIKey of 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol?
The InChIKey is BMVAYAANLOZADC-LLVKDONJSA-N. The full InChI is InChI=1S/C12H24N2O/c1-13-6-2-3-11(9-13)10-14-7-4-12(15)5-8-14/h11-12,15H,2-10H2,1H3/t11-/m1/s1.
What are the key properties of 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol?
1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol has a molecular weight of 212.34 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol is sourced from PubChem (CID 156719953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).