2-(3-amino-1-ethylpiperidin-3-yl)ethanol

C9H20N2O — CID 83914583

IUPAC2-(3-amino-1-ethylpiperidin-3-yl)ethanol
SMILESCCN1CCCC(N)(CCO)C1
InChIInChI=1S/C9H20N2O/c1-2-11-6-3-4-9(10,8-11)5-7-12/h12H,2-8,10H2,1H3
InChIKeyMFJUDQAGRPZLIA-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.18
Rot. Bonds3

About 2-(3-amino-1-ethylpiperidin-3-yl)ethanol

2-(3-amino-1-ethylpiperidin-3-yl)ethanol (PubChem CID 83914583) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(3-amino-1-ethylpiperidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(3-amino-1-ethylpiperidin-3-yl)ethanol
PubChem CID83914583
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-(3-amino-1-ethylpiperidin-3-yl)ethanol
SMILESCCN1CCCC(N)(CCO)C1
InChIInChI=1S/C9H20N2O/c1-2-11-6-3-4-9(10,8-11)5-7-12/h12H,2-8,10H2,1H3
InChIKeyMFJUDQAGRPZLIA-UHFFFAOYSA-N
XLogP0.18
TPSA49.49 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 ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3-amino-1-ethylazepan-3-yl)methanol
CID 142901054
2-[3-amino-1-(2-hydroxyethyl)pyrrolidin-3-yl]ethanol
CID 83914712
3-(aminomethyl)-1-ethylpiperidin-3-ol
CID 83914177
1-methyl-3-(2-pyrrolidin-1-ylethyl)piperidin-3-amine
CID 84734630
1-ethyl-3-methyl-3-propylpiperidine
CID 130676337
1-ethyl-3-(trifluoromethyl)piperidin-3-ol
CID 89019254
(3R)-1-ethyl-3-methylpiperidine-3-carboxylic acid
CID 26722586
methyl 3-amino-3-(2-hydroxyethyl)pyrrolidine-1-carboxylate
CID 83907147
CID 153390108
CID 153390108
8-ethyl-2-oxa-8-azaspiro[5.5]undecane
CID 153357345
1-ethyl-3-methyl-3-methylsulfanylpiperidine
CID 167009403
1-ethyl-3,3-dimethylazepane
CID 90730492

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-1-ethylpiperidin-3-yl)ethanol?
The IUPAC name of 2-(3-amino-1-ethylpiperidin-3-yl)ethanol (CID 83914583) is 2-(3-amino-1-ethylpiperidin-3-yl)ethanol.
What is the SMILES notation for 2-(3-amino-1-ethylpiperidin-3-yl)ethanol?
The canonical SMILES for 2-(3-amino-1-ethylpiperidin-3-yl)ethanol is CCN1CCCC(N)(CCO)C1.
What is the InChIKey of 2-(3-amino-1-ethylpiperidin-3-yl)ethanol?
The InChIKey is MFJUDQAGRPZLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-2-11-6-3-4-9(10,8-11)5-7-12/h12H,2-8,10H2,1H3.
What are the key properties of 2-(3-amino-1-ethylpiperidin-3-yl)ethanol?
2-(3-amino-1-ethylpiperidin-3-yl)ethanol has a molecular weight of 172.27 g/mol, XLogP of 0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-1-ethylpiperidin-3-yl)ethanol is sourced from PubChem (CID 83914583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).