N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide

C16H18N2O2 — CID 62689181

IUPACN-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)N(CCO)Cc1ccccc1
InChIInChI=1S/C16H18N2O2/c19-10-9-18(13-14-5-2-1-3-6-14)16(20)11-15-7-4-8-17-12-15/h1-8,12,19H,9-11,13H2
InChIKeyNCGLRVJKKMYEII-UHFFFAOYSA-N
MW270.33 g/mol
LogP1.65
Rot. Bonds6

About N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide

N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide (PubChem CID 62689181) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide
PubChem CID62689181
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)N(CCO)Cc1ccccc1
InChIInChI=1S/C16H18N2O2/c19-10-9-18(13-14-5-2-1-3-6-14)16(20)11-15-7-4-8-17-12-15/h1-8,12,19H,9-11,13H2
InChIKeyNCGLRVJKKMYEII-UHFFFAOYSA-N
XLogP1.65
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-N-(2-hydroxyethyl)-3-phenyl-N-(pyridin-3-ylmethyl)butanamide
CID 110026013
N-benzyl-N-[(1-hydroxycyclopentyl)methyl]-2-pyridin-3-ylacetamide
CID 75381637
N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)prop-2-enamide
CID 166414550
N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide
CID 60653994
N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
CID 60654052
3-[[2-[2-[benzyl(2-hydroxyethyl)carbamoyl]phenyl]benzoyl]-(2-pyridin-3-ylethyl)amino]propanoic acid
CID 69432761
N-benzyl-N-(2-hydroxyethyl)-2-(methylamino)acetamide
CID 58786294
N-benzyl-N-(2-hydroxyethyl)-3-(methylamino)pyridine-4-carboxamide
CID 105068839
N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)acetamide
CID 110724689
2-(5-chloro-1H-indol-3-yl)-N-(2-hydroxyethyl)-N-(pyridin-3-ylmethyl)acetamide
CID 75435791
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
N-benzyl-5-hydroxy-N-(2-hydroxyethyl)pentanamide
CID 79191990

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide?
The IUPAC name of N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide (CID 62689181) is N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide?
The canonical SMILES for N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide is O=C(Cc1cccnc1)N(CCO)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide?
The InChIKey is NCGLRVJKKMYEII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c19-10-9-18(13-14-5-2-1-3-6-14)16(20)11-15-7-4-8-17-12-15/h1-8,12,19H,9-11,13H2.
What are the key properties of N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide?
N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide has a molecular weight of 270.33 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide is sourced from PubChem (CID 62689181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).