N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide

C14H13ClN2O2 — CID 949027

IUPACN-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(Cl)cn2)cc1
InChIInChI=1S/C14H13ClN2O2/c1-19-12-5-2-10(3-6-12)8-14(18)17-13-7-4-11(15)9-16-13/h2-7,9H,8H2,1H3,(H,16,17,18)
InChIKeyQQBZHYPJOYHYDV-UHFFFAOYSA-N
MW276.72 g/mol
LogP2.92
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide

N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide (PubChem CID 949027) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide
PubChem CID949027
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC NameN-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(Cl)cn2)cc1
InChIInChI=1S/C14H13ClN2O2/c1-19-12-5-2-10(3-6-12)8-14(18)17-13-7-4-11(15)9-16-13/h2-7,9H,8H2,1H3,(H,16,17,18)
InChIKeyQQBZHYPJOYHYDV-UHFFFAOYSA-N
XLogP2.92
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide (CID 949027) is N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)Nc2ccc(Cl)cn2)cc1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide?
The InChIKey is QQBZHYPJOYHYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-19-12-5-2-10(3-6-12)8-14(18)17-13-7-4-11(15)9-16-13/h2-7,9H,8H2,1H3,(H,16,17,18).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide?
N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide has a molecular weight of 276.72 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 949027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).