[(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol

C8H18N2O — CID 129237634

IUPAC[(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol
SMILESCCN1C[C@H](N)CC[C@H]1CO
InChIInChI=1S/C8H18N2O/c1-2-10-5-7(9)3-4-8(10)6-11/h7-8,11H,2-6,9H2,1H3/t7-,8+/m1/s1
InChIKeyVEOZDCWTDPFHGB-SFYZADRCSA-N
MW158.24 g/mol
LogP-0.21
Rot. Bonds2

About [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol

[(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol (PubChem CID 129237634) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol
PubChem CID129237634
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name[(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol
SMILESCCN1C[C@H](N)CC[C@H]1CO
InChIInChI=1S/C8H18N2O/c1-2-10-5-7(9)3-4-8(10)6-11/h7-8,11H,2-6,9H2,1H3/t7-,8+/m1/s1
InChIKeyVEOZDCWTDPFHGB-SFYZADRCSA-N
XLogP-0.21
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1-ethylazepan-2-yl)methanol
CID 2849413
6-ethyl-1-methylsulfonylpiperidin-3-amine
CID 134294173
[(5S)-1-ethyl-5-propan-2-ylpyrrolidin-2-yl]methanol
CID 129252865
[(2S,4R)-1-ethyl-4-methylpiperidin-2-yl]methanol
CID 145404764
[(2S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-2-yl]methanol
CID 59117705
(3S)-1-ethylpyrrolidin-3-amine
CID 10678211
[(2R,5R)-1-butyl-5-methoxypiperidin-2-yl]methanol
CID 156651627
[(2S)-4-amino-1-propan-2-ylpyrrolidin-2-yl]methanol
CID 130193013
[1-(1-amino-2-methylpropan-2-yl)-4-methylpiperazin-2-yl]methanol
CID 83819424
(2S,4S)-4-amino-2-(hydroxymethyl)pyrrolidine-1-carboxylic acid
CID 138731797
[1-butyl-5-(hydroxymethyl)pyrrolidin-2-yl]methanol
CID 119095281
[(2R,5S)-1,5-dimethylpiperidin-2-yl]methanol
CID 118033473

Frequently Asked Questions

What is the IUPAC name of [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol?
The IUPAC name of [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol (CID 129237634) is [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol.
What is the SMILES notation for [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol?
The canonical SMILES for [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol is CCN1C[C@H](N)CC[C@H]1CO.
What is the InChIKey of [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol?
The InChIKey is VEOZDCWTDPFHGB-SFYZADRCSA-N. The full InChI is InChI=1S/C8H18N2O/c1-2-10-5-7(9)3-4-8(10)6-11/h7-8,11H,2-6,9H2,1H3/t7-,8+/m1/s1.
What are the key properties of [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol?
[(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol has a molecular weight of 158.24 g/mol, XLogP of -0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5R)-5-amino-1-ethylpiperidin-2-yl]methanol is sourced from PubChem (CID 129237634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).