N,1-dimethylpiperidin-3-amine;ethanol

C9H22N2O — CID 91223318

IUPACN,1-dimethylpiperidin-3-amine;ethanol
SMILESCCO.CNC1CCCN(C)C1
InChIInChI=1S/C7H16N2.C2H6O/c1-8-7-4-3-5-9(2)6-7;1-2-3/h7-8H,3-6H2,1-2H3;3H,2H2,1H3
InChIKeyYOMAYLIVMLLIGW-UHFFFAOYSA-N
MW174.29 g/mol
LogP0.30
Rot. Bonds1

About N,1-dimethylpiperidin-3-amine;ethanol

N,1-dimethylpiperidin-3-amine;ethanol (PubChem CID 91223318) has the molecular formula C9H22N2O and a molecular weight of 174.29 g/mol. Its IUPAC name is N,1-dimethylpiperidin-3-amine;ethanol.

Molecular Properties

Compound NameN,1-dimethylpiperidin-3-amine;ethanol
PubChem CID91223318
Molecular FormulaC9H22N2O
Molecular Weight174.29 g/mol
Exact Mass174.17
IUPAC NameN,1-dimethylpiperidin-3-amine;ethanol
SMILESCCO.CNC1CCCN(C)C1
InChIInChI=1S/C7H16N2.C2H6O/c1-8-7-4-3-5-9(2)6-7;1-2-3/h7-8H,3-6H2,1-2H3;3H,2H2,1H3
InChIKeyYOMAYLIVMLLIGW-UHFFFAOYSA-N
XLogP0.30
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-Methylpiperidin-4-yl)amino]ethan-1-ol
CID 3154447
2-(2-Methylpiperazin-1-yl)ethan-1-ol
CID 14747391
2-(1-Methylpiperazin-2-yl)ethanol
CID 6484682
3-(Methyl(piperidin-4-yl)amino)propan-1-ol
CID 12019499
1-(3-Methylpiperazin-1-yl)propan-2-ol
CID 14324892
1-(2-Ethylpiperazin-1-yl)propan-2-ol
CID 17954154
2-(Methyl(piperidin-4-yl)amino)ethan-1-ol
CID 28064309
2-[(1-Methylpiperidin-4-yl)amino]propan-1-ol
CID 43499738
2-(3-Aminopiperidin-1-yl)ethan-1-ol
CID 61296854
2-[(2R,6S)-2,6-dimethylpiperazin-1-yl]ethan-1-ol
CID 93500290
2-((3R)-3-aminopiperidin-1-yl)ethan-1-ol dihydrochloride
CID 138040531
2-(3-Methylpiperazin-1-yl)ethanol
CID 232250

Frequently Asked Questions

What is the IUPAC name of N,1-dimethylpiperidin-3-amine;ethanol?
The IUPAC name of N,1-dimethylpiperidin-3-amine;ethanol (CID 91223318) is N,1-dimethylpiperidin-3-amine;ethanol.
What is the SMILES notation for N,1-dimethylpiperidin-3-amine;ethanol?
The canonical SMILES for N,1-dimethylpiperidin-3-amine;ethanol is CCO.CNC1CCCN(C)C1.
What is the InChIKey of N,1-dimethylpiperidin-3-amine;ethanol?
The InChIKey is YOMAYLIVMLLIGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2.C2H6O/c1-8-7-4-3-5-9(2)6-7;1-2-3/h7-8H,3-6H2,1-2H3;3H,2H2,1H3.
What are the key properties of N,1-dimethylpiperidin-3-amine;ethanol?
N,1-dimethylpiperidin-3-amine;ethanol has a molecular weight of 174.29 g/mol, XLogP of 0.30, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethylpiperidin-3-amine;ethanol is sourced from PubChem (CID 91223318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).