N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide

C18H22N2O2 — CID 24765483

IUPACN-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(CC(=O)N[C@H](C)c2ccc(O)cn2)cc1
InChIInChI=1S/C18H22N2O2/c1-12(2)15-6-4-14(5-7-15)10-18(22)20-13(3)17-9-8-16(21)11-19-17/h4-9,11-13,21H,10H2,1-3H3,(H,20,22)/t13-/m1/s1
InChIKeyJQFVWQRBQFTVJB-CYBMUJFWSA-N
MW298.39 g/mol
LogP3.33
Rot. Bonds5

About N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide

N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide (PubChem CID 24765483) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide
PubChem CID24765483
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(CC(=O)N[C@H](C)c2ccc(O)cn2)cc1
InChIInChI=1S/C18H22N2O2/c1-12(2)15-6-4-14(5-7-15)10-18(22)20-13(3)17-9-8-16(21)11-19-17/h4-9,11-13,21H,10H2,1-3H3,(H,20,22)/t13-/m1/s1
InChIKeyJQFVWQRBQFTVJB-CYBMUJFWSA-N
XLogP3.33
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide (CID 24765483) is N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(CC(=O)N[C@H](C)c2ccc(O)cn2)cc1.
What is the InChIKey of N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide?
The InChIKey is JQFVWQRBQFTVJB-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-12(2)15-6-4-14(5-7-15)10-18(22)20-13(3)17-9-8-16(21)11-19-17/h4-9,11-13,21H,10H2,1-3H3,(H,20,22)/t13-/m1/s1.
What are the key properties of N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide?
N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide has a molecular weight of 298.39 g/mol, XLogP of 3.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(5-hydroxy-2-pyridinyl)ethyl]-2-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 24765483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).