(3R,4S)-1,3-diethylpiperidin-4-ol

C9H19NO — CID 129380803

IUPAC(3R,4S)-1,3-diethylpiperidin-4-ol
SMILESCC[C@@H]1CN(CC)CC[C@@H]1O
InChIInChI=1S/C9H19NO/c1-3-8-7-10(4-2)6-5-9(8)11/h8-9,11H,3-7H2,1-2H3/t8-,9+/m1/s1
InChIKeyMEBZXXVYEGQYLK-BDAKNGLRSA-N
MW157.26 g/mol
LogP1.10
Rot. Bonds2

About (3R,4S)-1,3-diethylpiperidin-4-ol

(3R,4S)-1,3-diethylpiperidin-4-ol (PubChem CID 129380803) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (3R,4S)-1,3-diethylpiperidin-4-ol.

Molecular Properties

Compound Name(3R,4S)-1,3-diethylpiperidin-4-ol
PubChem CID129380803
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(3R,4S)-1,3-diethylpiperidin-4-ol
SMILESCC[C@@H]1CN(CC)CC[C@@H]1O
InChIInChI=1S/C9H19NO/c1-3-8-7-10(4-2)6-5-9(8)11/h8-9,11H,3-7H2,1-2H3/t8-,9+/m1/s1
InChIKeyMEBZXXVYEGQYLK-BDAKNGLRSA-N
XLogP1.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(dimethylamino)ethyl]-3-ethylpiperidin-4-ol
CID 114511210
3-ethyl-1-(2-methylidenebutyl)piperidin-4-ol
CID 114511194
3-ethyl-1-heptylpiperidin-4-ol
CID 114510902
1-but-3-ynyl-3-ethylpiperidin-4-ol
CID 114511006
1-[(E)-3-chloroprop-2-enyl]-3-ethylpiperidin-4-ol
CID 114511079
3-[(3R,4S)-3-ethyl-4-hydroxypiperidin-1-yl]propanoic acid
CID 129497995
3-(3-ethyl-4-hydroxypiperidin-1-yl)propane-1,2-diol
CID 114511014
(3S,4R)-1-ethyl-3-methylpiperidin-4-ol
CID 143448112
1-benzyl-3-ethylpiperidin-4-ol
CID 23003710
2-(3-ethyl-4-hydroxypiperidin-1-yl)-N-methylacetamide
CID 114511071
(3S,4R)-1-ethyl-3-fluoropiperidin-4-ol
CID 67202820
1-ethyl-3-fluoropiperidin-4-ol
CID 58266532

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-1,3-diethylpiperidin-4-ol?
The IUPAC name of (3R,4S)-1,3-diethylpiperidin-4-ol (CID 129380803) is (3R,4S)-1,3-diethylpiperidin-4-ol.
What is the SMILES notation for (3R,4S)-1,3-diethylpiperidin-4-ol?
The canonical SMILES for (3R,4S)-1,3-diethylpiperidin-4-ol is CC[C@@H]1CN(CC)CC[C@@H]1O.
What is the InChIKey of (3R,4S)-1,3-diethylpiperidin-4-ol?
The InChIKey is MEBZXXVYEGQYLK-BDAKNGLRSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-8-7-10(4-2)6-5-9(8)11/h8-9,11H,3-7H2,1-2H3/t8-,9+/m1/s1.
What are the key properties of (3R,4S)-1,3-diethylpiperidin-4-ol?
(3R,4S)-1,3-diethylpiperidin-4-ol has a molecular weight of 157.26 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-1,3-diethylpiperidin-4-ol is sourced from PubChem (CID 129380803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).