(6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one

C12H23NO2 — CID 25258793

IUPAC(6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one
SMILESCCCC[C@@H](O)CC[C@H]1CCCC(=O)N1
InChIInChI=1S/C12H23NO2/c1-2-3-6-11(14)9-8-10-5-4-7-12(15)13-10/h10-11,14H,2-9H2,1H3,(H,13,15)/t10-,11-/m1/s1
InChIKeyULPBDFJWAGNCMG-GHMZBOCLSA-N
MW213.32 g/mol
LogP1.99
Rot. Bonds6

About (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one

(6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one (PubChem CID 25258793) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one.

Molecular Properties

Compound Name(6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one
PubChem CID25258793
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name(6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one
SMILESCCCC[C@@H](O)CC[C@H]1CCCC(=O)N1
InChIInChI=1S/C12H23NO2/c1-2-3-6-11(14)9-8-10-5-4-7-12(15)13-10/h10-11,14H,2-9H2,1H3,(H,13,15)/t10-,11-/m1/s1
InChIKeyULPBDFJWAGNCMG-GHMZBOCLSA-N
XLogP1.99
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Andrachcinidine
CID 101056755
1-[(2S,6R)-6-[(2S)-2-hydroxypentyl]piperidin-2-yl]propan-2-one
CID 10846934
N-[(2R,3R)-3-hydroxyheptadecan-2-yl]octanamide
CID 164619779
N-[(2S,3R)-3-hydroxyheptadecan-2-yl]octanamide
CID 164620710
N-[(2S,3S)-3-hydroxyheptadecan-2-yl]octanamide
CID 164622561
N-[(2R,3S)-3-hydroxyheptadecan-2-yl]octanamide
CID 164626679
N-(2-Hydroxycyclohexyl)octanamide
CID 3748464
(r)-N-propyl-12-hydroxyoctadecanamide
CID 53468279
N-dodecyl-12-hydroxyoctadecanamide
CID 175547056
12-hydroxy-N-propyloctadecanamide
CID 54058531
6-(2-Hydroxyethyl)piperidin-2-one
CID 14323983
4-Hydroxy-6-(2-methylpropyl)piperidin-2-one
CID 5246681

Frequently Asked Questions

What is the IUPAC name of (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one?
The IUPAC name of (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one (CID 25258793) is (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one.
What is the SMILES notation for (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one?
The canonical SMILES for (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one is CCCC[C@@H](O)CC[C@H]1CCCC(=O)N1.
What is the InChIKey of (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one?
The InChIKey is ULPBDFJWAGNCMG-GHMZBOCLSA-N. The full InChI is InChI=1S/C12H23NO2/c1-2-3-6-11(14)9-8-10-5-4-7-12(15)13-10/h10-11,14H,2-9H2,1H3,(H,13,15)/t10-,11-/m1/s1.
What are the key properties of (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one?
(6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one has a molecular weight of 213.32 g/mol, XLogP of 1.99, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-[(3R)-3-hydroxyheptyl]piperidin-2-one is sourced from PubChem (CID 25258793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).