N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide

C11H16N2O2 — CID 103961002

IUPACN-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide
SMILESCC[C@H](CO)NC(=O)Cc1ccncc1
InChIInChI=1S/C11H16N2O2/c1-2-10(8-14)13-11(15)7-9-3-5-12-6-4-9/h3-6,10,14H,2,7-8H2,1H3,(H,13,15)/t10-/m1/s1
InChIKeyDSLMZEWDJYONGP-SNVBAGLBSA-N
MW208.26 g/mol
LogP0.51
Rot. Bonds5

About N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide

N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide (PubChem CID 103961002) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide
PubChem CID103961002
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide
SMILESCC[C@H](CO)NC(=O)Cc1ccncc1
InChIInChI=1S/C11H16N2O2/c1-2-10(8-14)13-11(15)7-9-3-5-12-6-4-9/h3-6,10,14H,2,7-8H2,1H3,(H,13,15)/t10-/m1/s1
InChIKeyDSLMZEWDJYONGP-SNVBAGLBSA-N
XLogP0.51
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-cyanophenyl)-N-(1-hydroxybutan-2-yl)acetamide
CID 103944313
N-[(2R)-1-hydroxybutan-2-yl]-2-thiophen-3-ylacetamide
CID 103920243
N-[(2R)-1-hydroxybutan-2-yl]-2-(3-methyl-2-pyridinyl)acetamide
CID 107148274
(2R)-N-[(2S)-1-hydroxy-3-pyridin-4-ylpropan-2-yl]-2-[(2-phenylacetyl)amino]pentanamide
CID 100698551
(2S)-3-hydroxy-N,N-dipropyl-2-[(2-pyridin-4-ylacetyl)amino]propanamide
CID 6724746
2-(2-chlorophenyl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 103920161
N-[4-[2-(1-hydroxybutan-2-ylamino)-2-oxoethyl]phenyl]-2,3-dimethylpentanamide
CID 110025985
N-(1-hydroxypentan-3-yl)-2-pyridin-3-ylacetamide
CID 115767168
N-[1-(3-hydroxycyclobutyl)propyl]-2-pyridin-4-ylacetamide
CID 91781242
2-(2,5-dimethylphenyl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 103920089
N-(1-hydroxybutan-2-yl)-2-(2-methylsulfanylphenyl)acetamide
CID 110466057
N-(1,3-dihydroxypropan-2-yl)-2-(4-methoxyphenyl)acetamide
CID 65315308

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide?
The IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide (CID 103961002) is N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide?
The canonical SMILES for N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide is CC[C@H](CO)NC(=O)Cc1ccncc1.
What is the InChIKey of N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide?
The InChIKey is DSLMZEWDJYONGP-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-2-10(8-14)13-11(15)7-9-3-5-12-6-4-9/h3-6,10,14H,2,7-8H2,1H3,(H,13,15)/t10-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide?
N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide has a molecular weight of 208.26 g/mol, XLogP of 0.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxybutan-2-yl]-2-pyridin-4-ylacetamide is sourced from PubChem (CID 103961002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).