2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide

C11H16N2O2 — CID 175768787

IUPAC2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide
SMILESCC(C(N)=O)c1cccc(C(C)(C)O)n1
InChIInChI=1S/C11H16N2O2/c1-7(10(12)14)8-5-4-6-9(13-8)11(2,3)15/h4-7,15H,1-3H3,(H2,12,14)
InChIKeyZJULXJANTCDPQJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.90
Rot. Bonds3

About 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide

2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide (PubChem CID 175768787) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide
PubChem CID175768787
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide
SMILESCC(C(N)=O)c1cccc(C(C)(C)O)n1
InChIInChI=1S/C11H16N2O2/c1-7(10(12)14)8-5-4-6-9(13-8)11(2,3)15/h4-7,15H,1-3H3,(H2,12,14)
InChIKeyZJULXJANTCDPQJ-UHFFFAOYSA-N
XLogP0.90
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide?
The IUPAC name of 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide (CID 175768787) is 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide.
What is the SMILES notation for 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide?
The canonical SMILES for 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide is CC(C(N)=O)c1cccc(C(C)(C)O)n1.
What is the InChIKey of 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide?
The InChIKey is ZJULXJANTCDPQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7(10(12)14)8-5-4-6-9(13-8)11(2,3)15/h4-7,15H,1-3H3,(H2,12,14).
What are the key properties of 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide?
2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide has a molecular weight of 208.26 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2-hydroxypropan-2-yl)-2-pyridinyl]propanamide is sourced from PubChem (CID 175768787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).