(2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide

C17H26N2O3 — CID 129489903

IUPAC(2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide
SMILESNC(=O)[C@@H](O)C1CCN(C[C@H](O)CCc2ccccc2)CC1
InChIInChI=1S/C17H26N2O3/c18-17(22)16(21)14-8-10-19(11-9-14)12-15(20)7-6-13-4-2-1-3-5-13/h1-5,14-16,20-21H,6-12H2,(H2,18,22)/t15-,16+/m1/s1
InChIKeyHMMAGRSNKKESQR-CVEARBPZSA-N
MW306.41 g/mol
LogP0.54
Rot. Bonds7

About (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide

(2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide (PubChem CID 129489903) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide
PubChem CID129489903
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name(2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide
SMILESNC(=O)[C@@H](O)C1CCN(C[C@H](O)CCc2ccccc2)CC1
InChIInChI=1S/C17H26N2O3/c18-17(22)16(21)14-8-10-19(11-9-14)12-15(20)7-6-13-4-2-1-3-5-13/h1-5,14-16,20-21H,6-12H2,(H2,18,22)/t15-,16+/m1/s1
InChIKeyHMMAGRSNKKESQR-CVEARBPZSA-N
XLogP0.54
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide
CID 129490089
4-phenyl-1-piperidin-1-ylbutan-2-ol
CID 57323966
(2R)-2-hydroxy-2-[1-[3-(2-methylphenyl)propyl]piperidin-4-yl]acetamide
CID 129490064
4-phenyl-1-(3-phenylpiperidin-1-yl)butan-2-ol
CID 143402498
(2R)-2-hydroxy-2-[1-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-yl]acetamide
CID 129490248
(2S)-2-[1-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]piperidin-4-yl]-2-hydroxyacetamide
CID 129489869
(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide
CID 129489844
(2R)-2-hydroxy-2-[1-[(2-propan-2-yloxyphenyl)methyl]piperidin-4-yl]acetamide
CID 129489722
2-[4-[4-(1-hydroxy-3-phenylpropyl)piperidine-1-carbonyl]piperidin-1-yl]acetamide
CID 131930592
1,5-diphenylpentan-3-ol;hydrochloride
CID 139805992
(2R)-2-hydroxy-2-[1-[(4-methylquinazolin-2-yl)methyl]piperidin-4-yl]acetamide
CID 129490272
1-(4-methylpiperidin-1-yl)-3-[4-(2-phenylethyl)piperazin-1-yl]propan-2-ol
CID 110905075

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide?
The IUPAC name of (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide (CID 129489903) is (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide.
What is the SMILES notation for (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide?
The canonical SMILES for (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide is NC(=O)[C@@H](O)C1CCN(C[C@H](O)CCc2ccccc2)CC1.
What is the InChIKey of (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide?
The InChIKey is HMMAGRSNKKESQR-CVEARBPZSA-N. The full InChI is InChI=1S/C17H26N2O3/c18-17(22)16(21)14-8-10-19(11-9-14)12-15(20)7-6-13-4-2-1-3-5-13/h1-5,14-16,20-21H,6-12H2,(H2,18,22)/t15-,16+/m1/s1.
What are the key properties of (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide?
(2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide has a molecular weight of 306.41 g/mol, XLogP of 0.54, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 129489903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).