N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide

C16H20N4O2 — CID 119870649

IUPACN-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C16H20N4O2/c1-22-10-9-17-12-16(21)20-14-7-8-15(18-11-14)19-13-5-3-2-4-6-13/h2-8,11,17H,9-10,12H2,1H3,(H,18,19)(H,20,21)
InChIKeyPEKHSQMKQXLFIR-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.00
Rot. Bonds8

About N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide

N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide (PubChem CID 119870649) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide
PubChem CID119870649
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC NameN-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide
SMILESCOCCNCC(=O)Nc1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C16H20N4O2/c1-22-10-9-17-12-16(21)20-14-7-8-15(18-11-14)19-13-5-3-2-4-6-13/h2-8,11,17H,9-10,12H2,1H3,(H,18,19)(H,20,21)
InChIKeyPEKHSQMKQXLFIR-UHFFFAOYSA-N
XLogP2.00
TPSA75.28 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[5-[[2-(2-methoxyethylamino)acetyl]amino]-2-pyridinyl]acetic acid
CID 107340978
2-(2-methoxyethylamino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54819962
2-(2-methoxyethylamino)-N-(6-methylsulfonyl-3-pyridinyl)acetamide;dihydrochloride
CID 119854984
N-[3-(2-methoxyethoxy)phenyl]-2-(2-methoxyethylamino)acetamide
CID 54819707
2-[3-[[2-(2-methoxyethylamino)acetyl]amino]phenoxy]acetic acid
CID 79282011
N-(6-anilino-3-pyridinyl)-3-phenylpropanamide
CID 113016040
N-(3-acetamidophenyl)-2-(2-methoxyethylamino)acetamide
CID 54819836
2-(2-methoxyethylamino)-N-(1-phenylpyrazol-4-yl)acetamide;hydrochloride
CID 119753037
N-[6-(4-fluorophenoxy)-3-pyridinyl]-2-(2-methoxyethylamino)acetamide;dihydrochloride
CID 119849115
2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
N-(4-iodophenyl)-2-(2-methoxyethylamino)acetamide
CID 54819702
N-[6-(3,4-dimethylanilino)-3-pyridinyl]-2-phenoxyacetamide
CID 113016981

Frequently Asked Questions

What is the IUPAC name of N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide (CID 119870649) is N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide is COCCNCC(=O)Nc1ccc(Nc2ccccc2)nc1.
What is the InChIKey of N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide?
The InChIKey is PEKHSQMKQXLFIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-22-10-9-17-12-16(21)20-14-7-8-15(18-11-14)19-13-5-3-2-4-6-13/h2-8,11,17H,9-10,12H2,1H3,(H,18,19)(H,20,21).
What are the key properties of N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide?
N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide has a molecular weight of 300.36 g/mol, XLogP of 2.00, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-anilino-3-pyridinyl)-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 119870649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).