2-(1-pyridin-4-ylethylamino)acetamide

C9H13N3O — CID 16775752

IUPAC2-(1-pyridin-4-ylethylamino)acetamide
SMILESCC(NCC(N)=O)c1ccncc1
InChIInChI=1S/C9H13N3O/c1-7(12-6-9(10)13)8-2-4-11-5-3-8/h2-5,7,12H,6H2,1H3,(H2,10,13)
InChIKeyLZDOAMJYYAVBBA-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.22
Rot. Bonds4

About 2-(1-pyridin-4-ylethylamino)acetamide

2-(1-pyridin-4-ylethylamino)acetamide (PubChem CID 16775752) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-(1-pyridin-4-ylethylamino)acetamide.

Molecular Properties

Compound Name2-(1-pyridin-4-ylethylamino)acetamide
PubChem CID16775752
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name2-(1-pyridin-4-ylethylamino)acetamide
SMILESCC(NCC(N)=O)c1ccncc1
InChIInChI=1S/C9H13N3O/c1-7(12-6-9(10)13)8-2-4-11-5-3-8/h2-5,7,12H,6H2,1H3,(H2,10,13)
InChIKeyLZDOAMJYYAVBBA-UHFFFAOYSA-N
XLogP0.22
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1-pyridin-4-ylethylamino)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-carbamoyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81410117
N'-hydroxy-2-(1-pyridin-4-ylethylamino)ethanimidamide
CID 77029615
N,N-dimethyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81405917
N-ethyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81409863
N-pentan-2-yl-2-(1-pyridin-4-ylethylamino)acetamide
CID 60693847
2-[4-[(1-pyridin-4-ylethylamino)methyl]phenoxy]acetamide
CID 43181000
ethyl 2-[[[(1R)-1-pyridin-4-ylethyl]amino]methyl]prop-2-enoate
CID 103258974
2-[[(1S)-1-(4-propylphenyl)ethyl]amino]acetamide
CID 30045539
methyl 2-methyl-3-[[(1S)-1-pyridin-4-ylethyl]amino]propanoate
CID 81410031
N-(4-chlorophenyl)-2-[[(1R)-1-pyridin-4-ylethyl]amino]acetamide
CID 81410060
N-cyclopentyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81409773
2-[4-[[[(1S)-1-pyridin-4-ylethyl]amino]methyl]phenyl]acetic acid
CID 103258913

Frequently Asked Questions

What is the IUPAC name of 2-(1-pyridin-4-ylethylamino)acetamide?
The IUPAC name of 2-(1-pyridin-4-ylethylamino)acetamide (CID 16775752) is 2-(1-pyridin-4-ylethylamino)acetamide.
What is the SMILES notation for 2-(1-pyridin-4-ylethylamino)acetamide?
The canonical SMILES for 2-(1-pyridin-4-ylethylamino)acetamide is CC(NCC(N)=O)c1ccncc1.
What is the InChIKey of 2-(1-pyridin-4-ylethylamino)acetamide?
The InChIKey is LZDOAMJYYAVBBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-7(12-6-9(10)13)8-2-4-11-5-3-8/h2-5,7,12H,6H2,1H3,(H2,10,13).
What are the key properties of 2-(1-pyridin-4-ylethylamino)acetamide?
2-(1-pyridin-4-ylethylamino)acetamide has a molecular weight of 179.22 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-pyridin-4-ylethylamino)acetamide is sourced from PubChem (CID 16775752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).