(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide

C16H24N2O3 — CID 129489844

IUPAC(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide
SMILESCc1ccc([C@@H](O)CN2CCC([C@@H](O)C(N)=O)CC2)cc1
InChIInChI=1S/C16H24N2O3/c1-11-2-4-12(5-3-11)14(19)10-18-8-6-13(7-9-18)15(20)16(17)21/h2-5,13-15,19-20H,6-10H2,1H3,(H2,17,21)/t14-,15+/m0/s1
InChIKeyCHLKUOSALNTTQZ-LSDHHAIUSA-N
MW292.38 g/mol
LogP0.59
Rot. Bonds5

About (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide

(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide (PubChem CID 129489844) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide
PubChem CID129489844
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide
SMILESCc1ccc([C@@H](O)CN2CCC([C@@H](O)C(N)=O)CC2)cc1
InChIInChI=1S/C16H24N2O3/c1-11-2-4-12(5-3-11)14(19)10-18-8-6-13(7-9-18)15(20)16(17)21/h2-5,13-15,19-20H,6-10H2,1H3,(H2,17,21)/t14-,15+/m0/s1
InChIKeyCHLKUOSALNTTQZ-LSDHHAIUSA-N
XLogP0.59
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide?
The IUPAC name of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide (CID 129489844) is (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide.
What is the SMILES notation for (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide?
The canonical SMILES for (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide is Cc1ccc([C@@H](O)CN2CCC([C@@H](O)C(N)=O)CC2)cc1.
What is the InChIKey of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide?
The InChIKey is CHLKUOSALNTTQZ-LSDHHAIUSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11-2-4-12(5-3-11)14(19)10-18-8-6-13(7-9-18)15(20)16(17)21/h2-5,13-15,19-20H,6-10H2,1H3,(H2,17,21)/t14-,15+/m0/s1.
What are the key properties of (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide?
(2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide has a molecular weight of 292.38 g/mol, XLogP of 0.59, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-2-[1-[(2R)-2-hydroxy-2-(4-methylphenyl)ethyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 129489844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).