2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide

C10H11ClN4O2 — CID 106240014

IUPAC2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide
SMILESN#Cc1cc(Cl)nc(NCCOCC(N)=O)c1
InChIInChI=1S/C10H11ClN4O2/c11-8-3-7(5-12)4-10(15-8)14-1-2-17-6-9(13)16/h3-4H,1-2,6H2,(H2,13,16)(H,14,15)
InChIKeyLCJUDJSPXBAHRH-UHFFFAOYSA-N
MW254.68 g/mol
LogP0.52
Rot. Bonds6

About 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide

2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide (PubChem CID 106240014) has the molecular formula C10H11ClN4O2 and a molecular weight of 254.68 g/mol. Its IUPAC name is 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide
PubChem CID106240014
Molecular FormulaC10H11ClN4O2
Molecular Weight254.68 g/mol
Exact Mass254.06
IUPAC Name2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide
SMILESN#Cc1cc(Cl)nc(NCCOCC(N)=O)c1
InChIInChI=1S/C10H11ClN4O2/c11-8-3-7(5-12)4-10(15-8)14-1-2-17-6-9(13)16/h3-4H,1-2,6H2,(H2,13,16)(H,14,15)
InChIKeyLCJUDJSPXBAHRH-UHFFFAOYSA-N
XLogP0.52
TPSA101.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.68
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-[2-(2-methylprop-2-enoxy)ethylamino]pyridine-4-carbonitrile
CID 106196869
2-[2-[[6-chloro-2-(methoxymethyl)pyrimidin-4-yl]amino]ethoxy]acetamide
CID 114162689
2-[2-[(6-chloropyrimidin-4-yl)amino]ethoxy]acetamide
CID 106240051
2-[2-(3-bromo-5-cyanoanilino)ethoxy]acetamide
CID 114162215
2-chloro-6-(3-hydroxybutylamino)pyridine-4-carbonitrile
CID 83077171
ethyl 2-[(6-chloro-4-cyano-2-pyridinyl)amino]acetate
CID 83074601
N-[2-(2-amino-2-oxoethoxy)ethyl]-2-chloro-6-(ethylamino)pyridine-4-carboxamide
CID 106241191
2-chloro-6-[(3-hydroxy-4-methoxybutyl)amino]pyridine-4-carbonitrile
CID 106248382
2-[2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)amino]ethoxy]acetamide
CID 136805706
2-chloro-6-(6-hydroxyhexylamino)pyridine-4-carbonitrile
CID 107854040
2-[(4-cyano-6-methyl-2-pyridinyl)amino]ethyl carbamate
CID 114766558
2-[2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]ethoxy]acetamide
CID 106241808

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide (CID 106240014) is 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide is N#Cc1cc(Cl)nc(NCCOCC(N)=O)c1.
What is the InChIKey of 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide?
The InChIKey is LCJUDJSPXBAHRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O2/c11-8-3-7(5-12)4-10(15-8)14-1-2-17-6-9(13)16/h3-4H,1-2,6H2,(H2,13,16)(H,14,15).
What are the key properties of 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide?
2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide has a molecular weight of 254.68 g/mol, XLogP of 0.52, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(6-chloro-4-cyano-2-pyridinyl)amino]ethoxy]acetamide is sourced from PubChem (CID 106240014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).