2-[(3-chloro-2-pyridinyl)oxy]aniline

C11H9ClN2O — CID 43363998

IUPAC2-[(3-chloro-2-pyridinyl)oxy]aniline
SMILESNc1ccccc1Oc1ncccc1Cl
InChIInChI=1S/C11H9ClN2O/c12-8-4-3-7-14-11(8)15-10-6-2-1-5-9(10)13/h1-7H,13H2
InChIKeyARCAMVUAJZUSKE-UHFFFAOYSA-N
MW220.66 g/mol
LogP3.11
Rot. Bonds2

About 2-[(3-chloro-2-pyridinyl)oxy]aniline

2-[(3-chloro-2-pyridinyl)oxy]aniline (PubChem CID 43363998) has the molecular formula C11H9ClN2O and a molecular weight of 220.66 g/mol. Its IUPAC name is 2-[(3-chloro-2-pyridinyl)oxy]aniline.

Molecular Properties

Compound Name2-[(3-chloro-2-pyridinyl)oxy]aniline
PubChem CID43363998
Molecular FormulaC11H9ClN2O
Molecular Weight220.66 g/mol
Exact Mass220.04
IUPAC Name2-[(3-chloro-2-pyridinyl)oxy]aniline
SMILESNc1ccccc1Oc1ncccc1Cl
InChIInChI=1S/C11H9ClN2O/c12-8-4-3-7-14-11(8)15-10-6-2-1-5-9(10)13/h1-7H,13H2
InChIKeyARCAMVUAJZUSKE-UHFFFAOYSA-N
XLogP3.11
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.66
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(3-chloro-2-pyridinyl)oxy]naphthalen-1-amine
CID 55228286
2-[(3-methyl-2-pyridinyl)oxy]aniline
CID 62253528
5-bromo-2-[(3-chloro-2-pyridinyl)oxy]aniline
CID 65429796
3-(2-chlorophenoxy)pyrazin-2-amine
CID 102987821
2-(2-aminophenoxy)-3-chloropyridine-4-carbonitrile
CID 107061078
2-(2,6-dimethoxyphenoxy)pyridin-3-amine
CID 16783505
2-[(3-amino-2-pyridinyl)oxy]pyridin-3-amine
CID 71150824
5-bromo-2-[(3-chloro-2-pyridinyl)oxy]-3-methylaniline
CID 79842800
[4-chloro-2-[(3-chloro-2-pyridinyl)oxy]phenyl]methanamine
CID 114323941
2-[(2-methoxyphenyl)methoxy]pyridin-3-amine
CID 117096182
1-[(3-chloro-2-pyridinyl)oxy]isoquinoline
CID 123551407
2-[2-[2-(2-aminophenoxy)phenoxy]phenoxy]aniline
CID 22338600

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chloro-2-pyridinyl)oxy]aniline?
The IUPAC name of 2-[(3-chloro-2-pyridinyl)oxy]aniline (CID 43363998) is 2-[(3-chloro-2-pyridinyl)oxy]aniline.
What is the SMILES notation for 2-[(3-chloro-2-pyridinyl)oxy]aniline?
The canonical SMILES for 2-[(3-chloro-2-pyridinyl)oxy]aniline is Nc1ccccc1Oc1ncccc1Cl.
What is the InChIKey of 2-[(3-chloro-2-pyridinyl)oxy]aniline?
The InChIKey is ARCAMVUAJZUSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O/c12-8-4-3-7-14-11(8)15-10-6-2-1-5-9(10)13/h1-7H,13H2.
What are the key properties of 2-[(3-chloro-2-pyridinyl)oxy]aniline?
2-[(3-chloro-2-pyridinyl)oxy]aniline has a molecular weight of 220.66 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chloro-2-pyridinyl)oxy]aniline is sourced from PubChem (CID 43363998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).