(2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide

C20H26N2O3 — CID 118776253

IUPAC(2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide
SMILESCN1CCC(O)(CCNC(=O)[C@H](O)c2ccc3ccccc3c2)CC1
InChIInChI=1S/C20H26N2O3/c1-22-12-9-20(25,10-13-22)8-11-21-19(24)18(23)17-7-6-15-4-2-3-5-16(15)14-17/h2-7,14,18,23,25H,8-13H2,1H3,(H,21,24)/t18-/m1/s1
InChIKeyGUTBGTBKLMRWQV-GOSISDBHSA-N
MW342.44 g/mol
LogP1.84
Rot. Bonds5

About (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide

(2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide (PubChem CID 118776253) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound Name(2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide
PubChem CID118776253
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC Name(2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide
SMILESCN1CCC(O)(CCNC(=O)[C@H](O)c2ccc3ccccc3c2)CC1
InChIInChI=1S/C20H26N2O3/c1-22-12-9-20(25,10-13-22)8-11-21-19(24)18(23)17-7-6-15-4-2-3-5-16(15)14-17/h2-7,14,18,23,25H,8-13H2,1H3,(H,21,24)/t18-/m1/s1
InChIKeyGUTBGTBKLMRWQV-GOSISDBHSA-N
XLogP1.84
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide?
The IUPAC name of (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide (CID 118776253) is (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide.
What is the SMILES notation for (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide?
The canonical SMILES for (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide is CN1CCC(O)(CCNC(=O)[C@H](O)c2ccc3ccccc3c2)CC1.
What is the InChIKey of (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide?
The InChIKey is GUTBGTBKLMRWQV-GOSISDBHSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-22-12-9-20(25,10-13-22)8-11-21-19(24)18(23)17-7-6-15-4-2-3-5-16(15)14-17/h2-7,14,18,23,25H,8-13H2,1H3,(H,21,24)/t18-/m1/s1.
What are the key properties of (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide?
(2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide has a molecular weight of 342.44 g/mol, XLogP of 1.84, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-N-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 118776253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).