(6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one

C11H21NO2 — CID 66573750

IUPAC(6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one
SMILESCCCCC[C@@H](O)[C@H]1CCCC(=O)N1
InChIInChI=1S/C11H21NO2/c1-2-3-4-7-10(13)9-6-5-8-11(14)12-9/h9-10,13H,2-8H2,1H3,(H,12,14)/t9-,10-/m1/s1
InChIKeyVVKWXGVQCQMGGW-NXEZZACHSA-N
MW199.29 g/mol
LogP1.60
Rot. Bonds5

About (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one

(6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one (PubChem CID 66573750) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one.

Molecular Properties

Compound Name(6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one
PubChem CID66573750
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name(6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one
SMILESCCCCC[C@@H](O)[C@H]1CCCC(=O)N1
InChIInChI=1S/C11H21NO2/c1-2-3-4-7-10(13)9-6-5-8-11(14)12-9/h9-10,13H,2-8H2,1H3,(H,12,14)/t9-,10-/m1/s1
InChIKeyVVKWXGVQCQMGGW-NXEZZACHSA-N
XLogP1.60
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Ceramide NG
CID 5283573
N-(hexadecanoyl)-sphinganine
CID 5283572
C20 Dihydroceramide
CID 5283574
N-(docosanoyl)-sphinganine
CID 5283575
Hydroxystearamide monoethanolamide
CID 97916
Cer(d18:0/26:0)
CID 644245
N-tetracosanoylsphinganine
CID 5283577
Palmitamidohexadecanediol
CID 15511094
N-(tetradecanoyl)-sphinganine
CID 10255824
Cer(d18:0/8:0)
CID 6610274
N-[(2S,3R)-1,3-dihydroxyoctadecan-2-yl]hexanamide
CID 16219163
N-(dodecanoyl)-sphinganine
CID 53481046

Frequently Asked Questions

What is the IUPAC name of (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one?
The IUPAC name of (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one (CID 66573750) is (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one.
What is the SMILES notation for (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one?
The canonical SMILES for (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one is CCCCC[C@@H](O)[C@H]1CCCC(=O)N1.
What is the InChIKey of (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one?
The InChIKey is VVKWXGVQCQMGGW-NXEZZACHSA-N. The full InChI is InChI=1S/C11H21NO2/c1-2-3-4-7-10(13)9-6-5-8-11(14)12-9/h9-10,13H,2-8H2,1H3,(H,12,14)/t9-,10-/m1/s1.
What are the key properties of (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one?
(6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one has a molecular weight of 199.29 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-[(1R)-1-hydroxyhexyl]piperidin-2-one is sourced from PubChem (CID 66573750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).