(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide

C16H24N2O4 — CID 129490089

IUPAC(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide
SMILESNC(=O)[C@H](O)C1CCN(C[C@@H](O)COc2ccccc2)CC1
InChIInChI=1S/C16H24N2O4/c17-16(21)15(20)12-6-8-18(9-7-12)10-13(19)11-22-14-4-2-1-3-5-14/h1-5,12-13,15,19-20H,6-11H2,(H2,17,21)/t13-,15-/m1/s1
InChIKeyPQITYJUIDUHRHM-UKRRQHHQSA-N
MW308.38 g/mol
LogP-0.02
Rot. Bonds7

About (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide

(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide (PubChem CID 129490089) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide
PubChem CID129490089
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC Name(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide
SMILESNC(=O)[C@H](O)C1CCN(C[C@@H](O)COc2ccccc2)CC1
InChIInChI=1S/C16H24N2O4/c17-16(21)15(20)12-6-8-18(9-7-12)10-13(19)11-22-14-4-2-1-3-5-14/h1-5,12-13,15,19-20H,6-11H2,(H2,17,21)/t13-,15-/m1/s1
InChIKeyPQITYJUIDUHRHM-UKRRQHHQSA-N
XLogP-0.02
TPSA96.02 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(1-hydroxyethyl)piperidin-1-yl]-3-phenoxypropan-2-ol
CID 111113995
1-[(2R)-2-hydroxy-3-(4-phenylphenoxy)propyl]piperidine-4-carboxamide
CID 2520625
(2S)-2-hydroxy-2-[1-[(2R)-2-hydroxy-4-phenylbutyl]piperidin-4-yl]acetamide
CID 129489903
[1-(2-hydroxy-3-phenoxypropyl)piperidin-4-yl]-piperidin-1-ylmethanone
CID 110882103
2-[4-(2-hydroxy-3-phenoxypropyl)piperazin-1-yl]acetic acid
CID 119135376
1-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-3-phenoxypropan-2-ol
CID 138959633
1-(4-methylpiperidin-1-yl)-3-(4-phenylphenoxy)propan-2-ol
CID 2939361
cyclopentyl-[4-[(2R)-2-hydroxy-3-phenoxypropyl]piperazin-1-yl]methanone
CID 95934856
[1-(2-hydroxy-3-phenoxypropyl)piperidin-4-yl]-(4-methylphenyl)methanone
CID 87022270
1-[2-hydroxy-3-[4-(2-phenylpropan-2-yl)phenoxy]propyl]piperidine-4-carboxamide
CID 3519556
(2S)-2-amino-1-[4-(2-hydroxy-3-phenoxypropyl)piperazin-1-yl]butan-1-one
CID 119881232
1-phenoxy-3-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-2-ol
CID 4206507

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide?
The IUPAC name of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide (CID 129490089) is (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide.
What is the SMILES notation for (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide?
The canonical SMILES for (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide is NC(=O)[C@H](O)C1CCN(C[C@@H](O)COc2ccccc2)CC1.
What is the InChIKey of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide?
The InChIKey is PQITYJUIDUHRHM-UKRRQHHQSA-N. The full InChI is InChI=1S/C16H24N2O4/c17-16(21)15(20)12-6-8-18(9-7-12)10-13(19)11-22-14-4-2-1-3-5-14/h1-5,12-13,15,19-20H,6-11H2,(H2,17,21)/t13-,15-/m1/s1.
What are the key properties of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide?
(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide has a molecular weight of 308.38 g/mol, XLogP of -0.02, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-3-phenoxypropyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 129490089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).