(2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide

C11H23NO2 — CID 155268171

IUPAC(2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide
SMILESCCC[C@H](C(=O)NCCO)C(C)(C)C
InChIInChI=1S/C11H23NO2/c1-5-6-9(11(2,3)4)10(14)12-7-8-13/h9,13H,5-8H2,1-4H3,(H,12,14)/t9-/m1/s1
InChIKeyUAZQTNXKZQXTAO-SECBINFHSA-N
MW201.31 g/mol
LogP1.56
Rot. Bonds5

About (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide

(2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide (PubChem CID 155268171) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide.

Molecular Properties

Compound Name(2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide
PubChem CID155268171
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name(2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide
SMILESCCC[C@H](C(=O)NCCO)C(C)(C)C
InChIInChI=1S/C11H23NO2/c1-5-6-9(11(2,3)4)10(14)12-7-8-13/h9,13H,5-8H2,1-4H3,(H,12,14)/t9-/m1/s1
InChIKeyUAZQTNXKZQXTAO-SECBINFHSA-N
XLogP1.56
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide?
The IUPAC name of (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide (CID 155268171) is (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide.
What is the SMILES notation for (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide?
The canonical SMILES for (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide is CCC[C@H](C(=O)NCCO)C(C)(C)C.
What is the InChIKey of (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide?
The InChIKey is UAZQTNXKZQXTAO-SECBINFHSA-N. The full InChI is InChI=1S/C11H23NO2/c1-5-6-9(11(2,3)4)10(14)12-7-8-13/h9,13H,5-8H2,1-4H3,(H,12,14)/t9-/m1/s1.
What are the key properties of (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide?
(2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide has a molecular weight of 201.31 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-tert-butyl-N-(2-hydroxyethyl)pentanamide is sourced from PubChem (CID 155268171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).