N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide

C14H14ClN3O2 — CID 62962839

IUPACN-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
SMILESCc1ccn(CC(=O)Nc2cc(Cl)ccc2N)c(=O)c1
InChIInChI=1S/C14H14ClN3O2/c1-9-4-5-18(14(20)6-9)8-13(19)17-12-7-10(15)2-3-11(12)16/h2-7H,8,16H2,1H3,(H,17,19)
InChIKeyUCFYXBJZDXJXNT-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.03
Rot. Bonds3

About N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide

N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide (PubChem CID 62962839) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
PubChem CID62962839
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC NameN-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
SMILESCc1ccn(CC(=O)Nc2cc(Cl)ccc2N)c(=O)c1
InChIInChI=1S/C14H14ClN3O2/c1-9-4-5-18(14(20)6-9)8-13(19)17-12-7-10(15)2-3-11(12)16/h2-7H,8,16H2,1H3,(H,17,19)
InChIKeyUCFYXBJZDXJXNT-UHFFFAOYSA-N
XLogP2.03
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide (CID 62962839) is N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide is Cc1ccn(CC(=O)Nc2cc(Cl)ccc2N)c(=O)c1.
What is the InChIKey of N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide?
The InChIKey is UCFYXBJZDXJXNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-9-4-5-18(14(20)6-9)8-13(19)17-12-7-10(15)2-3-11(12)16/h2-7H,8,16H2,1H3,(H,17,19).
What are the key properties of N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide?
N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide has a molecular weight of 291.74 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 62962839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).