ethoxy-[(3R)-piperidin-3-yl]methanol

C8H17NO2 — CID 143093880

IUPACethoxy-[(3R)-piperidin-3-yl]methanol
SMILESCCOC(O)[C@@H]1CCCNC1
InChIInChI=1S/C8H17NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h7-10H,2-6H2,1H3/t7-,8?/m1/s1
InChIKeyXPNJKBMXVGKIQK-GVHYBUMESA-N
MW159.23 g/mol
LogP0.34
Rot. Bonds3

About ethoxy-[(3R)-piperidin-3-yl]methanol

ethoxy-[(3R)-piperidin-3-yl]methanol (PubChem CID 143093880) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is ethoxy-[(3R)-piperidin-3-yl]methanol.

Molecular Properties

Compound Nameethoxy-[(3R)-piperidin-3-yl]methanol
PubChem CID143093880
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Nameethoxy-[(3R)-piperidin-3-yl]methanol
SMILESCCOC(O)[C@@H]1CCCNC1
InChIInChI=1S/C8H17NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h7-10H,2-6H2,1H3/t7-,8?/m1/s1
InChIKeyXPNJKBMXVGKIQK-GVHYBUMESA-N
XLogP0.34
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-ethoxy-3-piperidin-3-ylpropan-1-amine
CID 105442327
3-methyl-1-piperidin-3-ylpentan-1-ol
CID 80559058
piperidin-3-ylmethanediol
CID 5231808
cyclopentyl(piperidin-3-yl)methanol
CID 80560291
(1R)-2-cyclopropyl-1-[(3S)-piperidin-3-yl]ethanol
CID 124570391
N-(2-ethoxypropyl)-3-piperidin-3-ylbutanamide
CID 115739458
2-cyclobutyl-1-piperidin-3-ylethanol
CID 105440851
ethoxy-(1-methylpiperidin-3-yl)methanol
CID 90952315
aziridin-2-yl(ethoxy)methanol
CID 163643755
1-(azepan-3-yl)pentan-1-ol
CID 67828850
3-amino-1-piperidin-3-ylpropan-1-ol
CID 82596067
3-methyl-1-piperidin-3-ylbutan-1-amine
CID 82412260

Frequently Asked Questions

What is the IUPAC name of ethoxy-[(3R)-piperidin-3-yl]methanol?
The IUPAC name of ethoxy-[(3R)-piperidin-3-yl]methanol (CID 143093880) is ethoxy-[(3R)-piperidin-3-yl]methanol.
What is the SMILES notation for ethoxy-[(3R)-piperidin-3-yl]methanol?
The canonical SMILES for ethoxy-[(3R)-piperidin-3-yl]methanol is CCOC(O)[C@@H]1CCCNC1.
What is the InChIKey of ethoxy-[(3R)-piperidin-3-yl]methanol?
The InChIKey is XPNJKBMXVGKIQK-GVHYBUMESA-N. The full InChI is InChI=1S/C8H17NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h7-10H,2-6H2,1H3/t7-,8?/m1/s1.
What are the key properties of ethoxy-[(3R)-piperidin-3-yl]methanol?
ethoxy-[(3R)-piperidin-3-yl]methanol has a molecular weight of 159.23 g/mol, XLogP of 0.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-[(3R)-piperidin-3-yl]methanol is sourced from PubChem (CID 143093880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).