(2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide

C19H28N2O3 — CID 129489619

IUPAC(2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide
SMILESC[C@](O)(CN1CCC([C@@H](O)C(=O)NC2CC2)CC1)c1ccccc1
InChIInChI=1S/C19H28N2O3/c1-19(24,15-5-3-2-4-6-15)13-21-11-9-14(10-12-21)17(22)18(23)20-16-7-8-16/h2-6,14,16-17,22,24H,7-13H2,1H3,(H,20,23)/t17-,19+/m1/s1
InChIKeyZMFBLRDTJKPPCY-MJGOQNOKSA-N
MW332.44 g/mol
LogP1.25
Rot. Bonds6

About (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide

(2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide (PubChem CID 129489619) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name(2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide
PubChem CID129489619
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC Name(2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide
SMILESC[C@](O)(CN1CCC([C@@H](O)C(=O)NC2CC2)CC1)c1ccccc1
InChIInChI=1S/C19H28N2O3/c1-19(24,15-5-3-2-4-6-15)13-21-11-9-14(10-12-21)17(22)18(23)20-16-7-8-16/h2-6,14,16-17,22,24H,7-13H2,1H3,(H,20,23)/t17-,19+/m1/s1
InChIKeyZMFBLRDTJKPPCY-MJGOQNOKSA-N
XLogP1.25
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-hydroxy-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]acetamide
CID 154753718
2-phenyl-1-(3-propan-2-ylpyrrolidin-1-yl)propan-2-ol
CID 112698258
1-(2-hydroxy-2-phenylpropyl)piperidine-4-carboxamide
CID 62373973
1-[4-(ethylaminomethyl)piperidin-1-yl]-2-phenylpropan-2-ol
CID 63847704
2-amino-2-phenyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]propanamide
CID 122084249
(2R)-N-cyclopropyl-2-hydroxy-2-[1-(3-methylbut-2-enyl)piperidin-4-yl]acetamide
CID 129489862
1-[3-[1-(ethylamino)ethyl]piperidin-1-yl]-2-phenylpropan-2-ol
CID 63854628
1-[4-(cyclopropylmethyl)piperazin-1-yl]-2-phenylpropan-2-ol
CID 62373658
1-(4,4-dimethylpiperidin-1-yl)-2-phenylpropan-2-ol
CID 62931095
(2R)-2-[1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidin-4-yl]-N-cyclopropyl-2-hydroxyacetamide
CID 129489061
(2R)-N-cyclopropyl-2-hydroxy-2-[1-(quinolin-2-ylmethyl)piperidin-4-yl]acetamide
CID 129489272
(2S)-N-cyclopropyl-2-hydroxy-2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide
CID 129490273

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide?
The IUPAC name of (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide (CID 129489619) is (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide.
What is the SMILES notation for (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide?
The canonical SMILES for (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide is C[C@](O)(CN1CCC([C@@H](O)C(=O)NC2CC2)CC1)c1ccccc1.
What is the InChIKey of (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide?
The InChIKey is ZMFBLRDTJKPPCY-MJGOQNOKSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-19(24,15-5-3-2-4-6-15)13-21-11-9-14(10-12-21)17(22)18(23)20-16-7-8-16/h2-6,14,16-17,22,24H,7-13H2,1H3,(H,20,23)/t17-,19+/m1/s1.
What are the key properties of (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide?
(2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide has a molecular weight of 332.44 g/mol, XLogP of 1.25, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopropyl-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-phenylpropyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 129489619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).