trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol

C11H22N2O — CID 131701466

IUPACtrans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol
SMILESCN(C)C1CCN([C@@H]2CC[C@H]2O)CC1
InChIInChI=1S/C11H22N2O/c1-12(2)9-5-7-13(8-6-9)10-3-4-11(10)14/h9-11,14H,3-8H2,1-2H3/t10-,11-/m1/s1
InChIKeyQIAXKLIWRCQREI-GHMZBOCLSA-N
MW198.31 g/mol
LogP0.54
Rot. Bonds2

About trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol

trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol (PubChem CID 131701466) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol
PubChem CID131701466
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Nametrans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol
SMILESCN(C)C1CCN([C@@H]2CC[C@H]2O)CC1
InChIInChI=1S/C11H22N2O/c1-12(2)9-5-7-13(8-6-9)10-3-4-11(10)14/h9-11,14H,3-8H2,1-2H3/t10-,11-/m1/s1
InChIKeyQIAXKLIWRCQREI-GHMZBOCLSA-N
XLogP0.54
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4-(dimethylamino)piperidin-1-yl]pyrrolidin-3-ol
CID 63702628
trans-(1R,2R)-2-[3-(dimethylamino)pyrrolidin-1-yl]cyclohexan-1-ol
CID 102732127
2-[3-(dimethylamino)pyrrolidin-1-yl]cyclododecan-1-ol
CID 63165145
trans-(1R,2R)-2-(azepan-1-yl)cyclobutan-1-ol
CID 131701520
2-piperazin-1-ylcyclobutan-1-ol
CID 165486406
2-[4-(hydroxymethyl)piperidin-1-yl]cyclobutan-1-ol
CID 126993246
1-[2-(aminomethyl)cyclobutyl]-N,N-dimethylpiperidin-4-amine
CID 80999986
2-(4-methylpiperidin-1-yl)cyclopentan-1-ol
CID 60712204
2-[4-(dimethylamino)piperidin-1-yl]cycloheptane-1-carboxylic acid
CID 55146891
1-[(1R,2R)-2-hydroxycyclopentyl]piperidin-4-ol
CID 102734322
7-[3-(dimethylamino)pyrrolidin-1-yl]-1,4-dioxaspiro[4.5]decan-8-ol
CID 63164876
N,N-dimethyl-1-(4-methylpiperidin-3-yl)piperidin-4-amine
CID 66271353

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol?
The IUPAC name of trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol (CID 131701466) is trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol is CN(C)C1CCN([C@@H]2CC[C@H]2O)CC1.
What is the InChIKey of trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol?
The InChIKey is QIAXKLIWRCQREI-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H22N2O/c1-12(2)9-5-7-13(8-6-9)10-3-4-11(10)14/h9-11,14H,3-8H2,1-2H3/t10-,11-/m1/s1.
What are the key properties of trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol?
trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol has a molecular weight of 198.31 g/mol, XLogP of 0.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-[4-(dimethylamino)piperidin-1-yl]cyclobutan-1-ol is sourced from PubChem (CID 131701466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).