(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol

C10H21NO — CID 51697339

IUPAC(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol
SMILESCCCN1CCC[C@@H]([C@@H](C)O)C1
InChIInChI=1S/C10H21NO/c1-3-6-11-7-4-5-10(8-11)9(2)12/h9-10,12H,3-8H2,1-2H3/t9-,10-/m1/s1
InChIKeyQDWRCNCPOBBLRJ-NXEZZACHSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds3

About (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol

(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol (PubChem CID 51697339) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol
PubChem CID51697339
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol
SMILESCCCN1CCC[C@@H]([C@@H](C)O)C1
InChIInChI=1S/C10H21NO/c1-3-6-11-7-4-5-10(8-11)9(2)12/h9-10,12H,3-8H2,1-2H3/t9-,10-/m1/s1
InChIKeyQDWRCNCPOBBLRJ-NXEZZACHSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol?
The IUPAC name of (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol (CID 51697339) is (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol.
What is the SMILES notation for (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol?
The canonical SMILES for (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol is CCCN1CCC[C@@H]([C@@H](C)O)C1.
What is the InChIKey of (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol?
The InChIKey is QDWRCNCPOBBLRJ-NXEZZACHSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-6-11-7-4-5-10(8-11)9(2)12/h9-10,12H,3-8H2,1-2H3/t9-,10-/m1/s1.
What are the key properties of (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol?
(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol is sourced from PubChem (CID 51697339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).