N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide

C16H19N3O2 — CID 82898701

IUPACN-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide
SMILESO=C(CNCCn1ccccc1=O)NCc1ccccc1
InChIInChI=1S/C16H19N3O2/c20-15(18-12-14-6-2-1-3-7-14)13-17-9-11-19-10-5-4-8-16(19)21/h1-8,10,17H,9,11-13H2,(H,18,20)
InChIKeyFWSPAJCCTWBFDQ-UHFFFAOYSA-N
MW285.35 g/mol
LogP0.75
Rot. Bonds7

About N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide

N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide (PubChem CID 82898701) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide
PubChem CID82898701
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide
SMILESO=C(CNCCn1ccccc1=O)NCc1ccccc1
InChIInChI=1S/C16H19N3O2/c20-15(18-12-14-6-2-1-3-7-14)13-17-9-11-19-10-5-4-8-16(19)21/h1-8,10,17H,9,11-13H2,(H,18,20)
InChIKeyFWSPAJCCTWBFDQ-UHFFFAOYSA-N
XLogP0.75
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(benzylamino)ethyl]pyridin-2-one
CID 55070999
N-benzyl-2-(2-phenylethylamino)acetamide
CID 28829660
N-[(4-fluorophenyl)methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 86979441
N-[(4-fluorophenyl)methyl]-2-(2-phenylethylamino)acetamide
CID 108997842
N-methyl-3-[2-(2-oxo-1-pyridinyl)ethylamino]propanamide
CID 82897118
N-[(4-chlorophenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 27686969
4-[2-(2-oxo-1-pyridinyl)ethylamino]butanamide
CID 82897026
3-(2-oxo-1-pyridinyl)-N-[(3-phenylmethoxyphenyl)methyl]propanamide
CID 87018968
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 110908908
2-(2-oxo-1-pyridinyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide
CID 24643030
4-oxo-N-[[4-[(2-oxo-1-pyridinyl)methyl]phenyl]methyl]-4-phenylbutanamide
CID 47071053
2-[[[2-(benzylamino)-2-oxoethyl]amino]methyl]prop-2-enoic acid
CID 103240670

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide?
The IUPAC name of N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide (CID 82898701) is N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide.
What is the SMILES notation for N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide?
The canonical SMILES for N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide is O=C(CNCCn1ccccc1=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide?
The InChIKey is FWSPAJCCTWBFDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c20-15(18-12-14-6-2-1-3-7-14)13-17-9-11-19-10-5-4-8-16(19)21/h1-8,10,17H,9,11-13H2,(H,18,20).
What are the key properties of N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide?
N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide has a molecular weight of 285.35 g/mol, XLogP of 0.75, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[2-(2-oxo-1-pyridinyl)ethylamino]acetamide is sourced from PubChem (CID 82898701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).