(3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide

C21H40N2O3 — CID 10595238

IUPAC(3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide
SMILESCCCCCCCCCCCCC[C@@H](O)CC(=O)N[C@@H]1CCCNC1=O
InChIInChI=1S/C21H40N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-18(24)17-20(25)23-19-15-13-16-22-21(19)26/h18-19,24H,2-17H2,1H3,(H,22,26)(H,23,25)/t18-,19-/m1/s1
InChIKeyGTEMESDTKVZTDM-RTBURBONSA-N
MW368.56 g/mol
LogP3.83
Rot. Bonds15

About (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide

(3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide (PubChem CID 10595238) has the molecular formula C21H40N2O3 and a molecular weight of 368.56 g/mol. Its IUPAC name is (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide.

Molecular Properties

Compound Name(3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide
PubChem CID10595238
Molecular FormulaC21H40N2O3
Molecular Weight368.56 g/mol
Exact Mass368.30
IUPAC Name(3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide
SMILESCCCCCCCCCCCCC[C@@H](O)CC(=O)N[C@@H]1CCCNC1=O
InChIInChI=1S/C21H40N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-18(24)17-20(25)23-19-15-13-16-22-21(19)26/h18-19,24H,2-17H2,1H3,(H,22,26)(H,23,25)/t18-,19-/m1/s1
InChIKeyGTEMESDTKVZTDM-RTBURBONSA-N
XLogP3.83
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.56
LogP ≤ 53.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(3S)-2-oxoazepan-3-yl]octadecanamide
CID 11246417
3-hydroxy-N-(2-oxooxolan-3-yl)tridecanamide
CID 11515162
3-(undecan-6-ylamino)piperidin-2-one
CID 55033580
4-amino-3-methoxy-N-(2-oxopiperidin-3-yl)butanamide
CID 103155744
1-decyl-3-[(3S)-2-oxoazepan-3-yl]urea
CID 11392789
3-(dodecylamino)piperidin-2-one
CID 63492267
(2R)-2-ethyl-N-[(3S)-2-oxoazepan-3-yl]hexanamide
CID 11379810
3-(hexan-2-ylamino)piperidin-2-one
CID 62094120
3-(pentylamino)piperidin-2-one
CID 62093756
(2S)-2-hydroxy-N-(2-oxopiperidin-3-yl)propanamide
CID 130978731
6-oxo-6-[(2-oxopiperidin-3-yl)amino]hexanoic acid
CID 55033636
(Z,3S)-3-hydroxy-N-[(3R)-2-oxooxolan-3-yl]tetradec-7-enamide
CID 24882438

Frequently Asked Questions

What is the IUPAC name of (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide?
The IUPAC name of (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide (CID 10595238) is (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide.
What is the SMILES notation for (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide?
The canonical SMILES for (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide is CCCCCCCCCCCCC[C@@H](O)CC(=O)N[C@@H]1CCCNC1=O.
What is the InChIKey of (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide?
The InChIKey is GTEMESDTKVZTDM-RTBURBONSA-N. The full InChI is InChI=1S/C21H40N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-18(24)17-20(25)23-19-15-13-16-22-21(19)26/h18-19,24H,2-17H2,1H3,(H,22,26)(H,23,25)/t18-,19-/m1/s1.
What are the key properties of (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide?
(3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide has a molecular weight of 368.56 g/mol, XLogP of 3.83, 15 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-hydroxy-N-[(3R)-2-oxopiperidin-3-yl]hexadecanamide is sourced from PubChem (CID 10595238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).