5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine

C14H14Cl2N2O — CID 104536489

IUPAC5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine
SMILESCCCNc1cncc(Oc2cccc(Cl)c2Cl)c1
InChIInChI=1S/C14H14Cl2N2O/c1-2-6-18-10-7-11(9-17-8-10)19-13-5-3-4-12(15)14(13)16/h3-5,7-9,18H,2,6H2,1H3
InChIKeyFPZOXDAYCNDGLQ-UHFFFAOYSA-N
MW297.19 g/mol
LogP5.00
Rot. Bonds5

About 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine

5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine (PubChem CID 104536489) has the molecular formula C14H14Cl2N2O and a molecular weight of 297.19 g/mol. Its IUPAC name is 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine.

Molecular Properties

Compound Name5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine
PubChem CID104536489
Molecular FormulaC14H14Cl2N2O
Molecular Weight297.19 g/mol
Exact Mass296.05
IUPAC Name5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine
SMILESCCCNc1cncc(Oc2cccc(Cl)c2Cl)c1
InChIInChI=1S/C14H14Cl2N2O/c1-2-6-18-10-7-11(9-17-8-10)19-13-5-3-4-12(15)14(13)16/h3-5,7-9,18H,2,6H2,1H3
InChIKeyFPZOXDAYCNDGLQ-UHFFFAOYSA-N
XLogP5.00
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.19
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,3-dimethylphenoxy)-N-propylpyridin-3-amine
CID 104536354
N-propyl-5-quinolin-5-yloxypyridin-3-amine
CID 103046193
2-fluoro-6-[[5-(propylamino)-3-pyridinyl]oxy]benzonitrile
CID 104536574
5-(3-tert-butylphenoxy)-N-propylpyridin-3-amine
CID 104536558
N-propyl-5-[3-(trifluoromethyl)phenoxy]pyridin-3-amine
CID 104536494
5-(4-ethyl-2-methoxyphenoxy)-N-propylpyridin-3-amine
CID 107669663
5-(2-methyl-5-propan-2-ylphenoxy)-N-propylpyridin-3-amine
CID 104536595
5-[(5-bromo-3-pyridinyl)oxy]-N-propylpyridin-3-amine
CID 104536852
5-(5-bromo-2,3-difluorophenoxy)-N-propylpyridin-3-amine
CID 107102609
5-N-(3-chloro-2-fluorophenyl)-3-N-propylpyridine-3,5-diamine
CID 104532112
5-(4-methyl-2-nitrophenoxy)-N-propylpyridin-3-amine
CID 104536675
5-butoxy-N-propylpyridin-3-amine
CID 104536219

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine?
The IUPAC name of 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine (CID 104536489) is 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine.
What is the SMILES notation for 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine?
The canonical SMILES for 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine is CCCNc1cncc(Oc2cccc(Cl)c2Cl)c1.
What is the InChIKey of 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine?
The InChIKey is FPZOXDAYCNDGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O/c1-2-6-18-10-7-11(9-17-8-10)19-13-5-3-4-12(15)14(13)16/h3-5,7-9,18H,2,6H2,1H3.
What are the key properties of 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine?
5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine has a molecular weight of 297.19 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dichlorophenoxy)-N-propylpyridin-3-amine is sourced from PubChem (CID 104536489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).