3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol

C9H20N2O — CID 114681093

IUPAC3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol
SMILESCNCCN1CCC(O)C(C)C1
InChIInChI=1S/C9H20N2O/c1-8-7-11(6-4-10-2)5-3-9(8)12/h8-10,12H,3-7H2,1-2H3
InChIKeyUCDCZWUPEALAHH-UHFFFAOYSA-N
MW172.27 g/mol
LogP-0.09
Rot. Bonds3

About 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol

3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol (PubChem CID 114681093) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol
PubChem CID114681093
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol
SMILESCNCCN1CCC(O)C(C)C1
InChIInChI=1S/C9H20N2O/c1-8-7-11(6-4-10-2)5-3-9(8)12/h8-10,12H,3-7H2,1-2H3
InChIKeyUCDCZWUPEALAHH-UHFFFAOYSA-N
XLogP-0.09
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Amino-3-(3-methylpiperidin-1-yl)propan-2-ol
CID 3161650
1-(2-Aminoethyl)piperidin-4-ol
CID 2756425
3-Methylpiperidin-4-ol
CID 4713502
rac-(3R,4S)-3-methylpiperidin-4-ol
CID 7446786
3-Methylpiperidin-4-ol hydrochloride
CID 46736376
3,5-Dimethylpiperidin-4-ol hydrochloride
CID 67315068
rac-(3R,4R)-3-methylpiperidin-4-ol hydrochloride
CID 69092478
[3-(Dimethylamino)piperidin-4-YL]methanol
CID 86820533
2,5-Trimethyl-4-piperidinol
CID 148220
1-[(Piperidin-4-yl)methyl]piperidin-4-ol
CID 22047942
Piperazinopropyl ethanol
CID 53809642
Hydroxyethyl piperazine-2-ethane
CID 140201774

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol?
The IUPAC name of 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol (CID 114681093) is 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol.
What is the SMILES notation for 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol?
The canonical SMILES for 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol is CNCCN1CCC(O)C(C)C1.
What is the InChIKey of 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol?
The InChIKey is UCDCZWUPEALAHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-8-7-11(6-4-10-2)5-3-9(8)12/h8-10,12H,3-7H2,1-2H3.
What are the key properties of 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol?
3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol has a molecular weight of 172.27 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[2-(methylamino)ethyl]piperidin-4-ol is sourced from PubChem (CID 114681093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).