N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide

C12H10ClN3O2 — CID 2800542

IUPACN-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2cncc(Cl)c2)nc1
InChIInChI=1S/C12H10ClN3O2/c1-8(17)16-10-2-3-12(15-6-10)18-11-4-9(13)5-14-7-11/h2-7H,1H3,(H,16,17)
InChIKeyNDVWJZWMKPEUHP-UHFFFAOYSA-N
MW263.68 g/mol
LogP2.88
Rot. Bonds3

About N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide

N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide (PubChem CID 2800542) has the molecular formula C12H10ClN3O2 and a molecular weight of 263.68 g/mol. Its IUPAC name is N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide
PubChem CID2800542
Molecular FormulaC12H10ClN3O2
Molecular Weight263.68 g/mol
Exact Mass263.05
IUPAC NameN-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2cncc(Cl)c2)nc1
InChIInChI=1S/C12H10ClN3O2/c1-8(17)16-10-2-3-12(15-6-10)18-11-4-9(13)5-14-7-11/h2-7H,1H3,(H,16,17)
InChIKeyNDVWJZWMKPEUHP-UHFFFAOYSA-N
XLogP2.88
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.68
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide?
The IUPAC name of N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide (CID 2800542) is N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide.
What is the SMILES notation for N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide?
The canonical SMILES for N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide is CC(=O)Nc1ccc(Oc2cncc(Cl)c2)nc1.
What is the InChIKey of N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide?
The InChIKey is NDVWJZWMKPEUHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O2/c1-8(17)16-10-2-3-12(15-6-10)18-11-4-9(13)5-14-7-11/h2-7H,1H3,(H,16,17).
What are the key properties of N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide?
N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide has a molecular weight of 263.68 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(5-chloro-3-pyridinyl)oxy]-3-pyridinyl]acetamide is sourced from PubChem (CID 2800542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).