(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine

C14H14Cl2N2O — CID 103937652

IUPAC(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(Oc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C14H14Cl2N2O/c1-2-11(17)12-7-6-9(8-18-12)19-13-5-3-4-10(15)14(13)16/h3-8,11H,2,17H2,1H3/t11-/m1/s1
InChIKeyLEFYZGXEDJWWTB-LLVKDONJSA-N
MW297.19 g/mol
LogP4.59
Rot. Bonds4

About (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine

(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine (PubChem CID 103937652) has the molecular formula C14H14Cl2N2O and a molecular weight of 297.19 g/mol. Its IUPAC name is (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine
PubChem CID103937652
Molecular FormulaC14H14Cl2N2O
Molecular Weight297.19 g/mol
Exact Mass296.05
IUPAC Name(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(Oc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C14H14Cl2N2O/c1-2-11(17)12-7-6-9(8-18-12)19-13-5-3-4-10(15)14(13)16/h3-8,11H,2,17H2,1H3/t11-/m1/s1
InChIKeyLEFYZGXEDJWWTB-LLVKDONJSA-N
XLogP4.59
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.19
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]propan-1-amine
CID 103938021
1-[5-(2-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 115939981
(1R)-1-(5-quinolin-5-yloxy-2-pyridinyl)propan-1-amine
CID 103044924
(1S)-1-[5-(3,5-dichlorophenoxy)-2-pyridinyl]propan-1-amine
CID 103937870
2-[[6-[(1R)-1-aminopropyl]-3-pyridinyl]oxy]benzamide
CID 103937678
(1S)-1-[5-(4-chloro-3-fluorophenoxy)-2-pyridinyl]propan-1-amine
CID 103938051
1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine
CID 112584748
(1S)-1-[5-(4-iodophenoxy)-2-pyridinyl]propan-1-amine
CID 103937836
(1S)-1-[5-(4-bromophenoxy)-2-pyridinyl]propan-1-amine
CID 103937759
(1S)-1-(5-butan-2-yloxy-2-pyridinyl)propan-1-amine
CID 103937876
1-[5-(2-bromo-4-methoxyphenoxy)-2-pyridinyl]propan-1-amine
CID 104707911
(1R)-1-[5-(2-methyl-5-propan-2-ylphenoxy)-2-pyridinyl]propan-1-amine
CID 103937883

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine?
The IUPAC name of (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine (CID 103937652) is (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine?
The canonical SMILES for (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine is CC[C@@H](N)c1ccc(Oc2cccc(Cl)c2Cl)cn1.
What is the InChIKey of (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine?
The InChIKey is LEFYZGXEDJWWTB-LLVKDONJSA-N. The full InChI is InChI=1S/C14H14Cl2N2O/c1-2-11(17)12-7-6-9(8-18-12)19-13-5-3-4-10(15)14(13)16/h3-8,11H,2,17H2,1H3/t11-/m1/s1.
What are the key properties of (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine?
(1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine has a molecular weight of 297.19 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(2,3-dichlorophenoxy)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 103937652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).