N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide

C16H23N3O2 — CID 103843309

IUPACN-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
SMILESCCC(CC)(CO)CNC(=O)Cc1cn2ccccc2n1
InChIInChI=1S/C16H23N3O2/c1-3-16(4-2,12-20)11-17-15(21)9-13-10-19-8-6-5-7-14(19)18-13/h5-8,10,20H,3-4,9,11-12H2,1-2H3,(H,17,21)
InChIKeyWXFNVSVRZVFDDM-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.79
Rot. Bonds7

About N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide

N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide (PubChem CID 103843309) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
PubChem CID103843309
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
SMILESCCC(CC)(CO)CNC(=O)Cc1cn2ccccc2n1
InChIInChI=1S/C16H23N3O2/c1-3-16(4-2,12-20)11-17-15(21)9-13-10-19-8-6-5-7-14(19)18-13/h5-8,10,20H,3-4,9,11-12H2,1-2H3,(H,17,21)
InChIKeyWXFNVSVRZVFDDM-UHFFFAOYSA-N
XLogP1.79
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-2-ethylbutyl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 119639792
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 103891005
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]acetic acid
CID 43170541
N-[2-(furan-2-yl)-2-hydroxypropyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 111481890
2-[[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]methyl]-3-methylbutanoic acid
CID 65220306
N-(1-hydroxybutan-2-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 43417878
N-(1-hydroxy-4,4-dimethylpentan-3-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 103941094
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propanoic acid
CID 43355303
(2S)-2-hydroxy-3-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]propanoic acid
CID 107833206
N-(1-amino-2-methylpropan-2-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 119521483
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]pentanoic acid
CID 43630447
2-[(2-imidazo[1,2-a]pyridin-2-ylacetyl)amino]butanoic acid
CID 43469348

Frequently Asked Questions

What is the IUPAC name of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide?
The IUPAC name of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide (CID 103843309) is N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide.
What is the SMILES notation for N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide?
The canonical SMILES for N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide is CCC(CC)(CO)CNC(=O)Cc1cn2ccccc2n1.
What is the InChIKey of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide?
The InChIKey is WXFNVSVRZVFDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-3-16(4-2,12-20)11-17-15(21)9-13-10-19-8-6-5-7-14(19)18-13/h5-8,10,20H,3-4,9,11-12H2,1-2H3,(H,17,21).
What are the key properties of N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide?
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide has a molecular weight of 289.38 g/mol, XLogP of 1.79, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-ethyl-2-(hydroxymethyl)butyl]-2-imidazo[1,2-a]pyridin-2-ylacetamide is sourced from PubChem (CID 103843309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).