(2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide

C15H14Cl2N2O2 — CID 27233794

IUPAC(2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)[C@H](C)Oc2cccc(Cl)c2Cl)nc1
InChIInChI=1S/C15H14Cl2N2O2/c1-9-6-7-13(18-8-9)19-15(20)10(2)21-12-5-3-4-11(16)14(12)17/h3-8,10H,1-2H3,(H,18,19,20)/t10-/m0/s1
InChIKeyORDUBTFRJHUXLP-JTQLQIEISA-N
MW325.20 g/mol
LogP4.10
Rot. Bonds4

About (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide

(2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide (PubChem CID 27233794) has the molecular formula C15H14Cl2N2O2 and a molecular weight of 325.20 g/mol. Its IUPAC name is (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide
PubChem CID27233794
Molecular FormulaC15H14Cl2N2O2
Molecular Weight325.20 g/mol
Exact Mass324.04
IUPAC Name(2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)[C@H](C)Oc2cccc(Cl)c2Cl)nc1
InChIInChI=1S/C15H14Cl2N2O2/c1-9-6-7-13(18-8-9)19-15(20)10(2)21-12-5-3-4-11(16)14(12)17/h3-8,10H,1-2H3,(H,18,19,20)/t10-/m0/s1
InChIKeyORDUBTFRJHUXLP-JTQLQIEISA-N
XLogP4.10
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.20
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(2,3-dichlorophenoxy)-N-[2-(3-hydroxyphenyl)pyrimidin-5-yl]propanamide
CID 52523220
(2R)-2-(2,3-dichlorophenoxy)-N-[2-(3-hydroxyphenyl)pyrimidin-5-yl]propanamide
CID 52523221
2-(2,3-dichlorophenoxy)-N-(1,3-thiazol-2-yl)propanamide
CID 43077311
2-(2-chlorophenoxy)-N-(4-methyl-2-pyridinyl)propanamide
CID 46581275
2-(2,3-dichlorophenoxy)-N-quinolin-3-ylpropanamide
CID 46453335
(2R)-2-(2,3-dichlorophenoxy)-N-(3,5-dichlorophenyl)propanamide
CID 7787703
2-(2,3-dichlorophenoxy)-N-(4-fluorophenyl)propanamide
CID 42990420
(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide
CID 61147752
N-(5-chloro-2-pyridinyl)-2-(2,4-dichlorophenoxy)propanamide
CID 2939243
(2S)-2-(2,3-dichlorophenoxy)-N-(2-methoxyphenyl)propanamide
CID 7372354
(2R)-2-(4-cyanophenoxy)-N-(5-methyl-2-pyridinyl)propanamide
CID 40953055
(2S)-N-(5-methyl-2-pyridinyl)-2-phenylmethoxypropanamide
CID 51941390

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
The IUPAC name of (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide (CID 27233794) is (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
The canonical SMILES for (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide is Cc1ccc(NC(=O)[C@H](C)Oc2cccc(Cl)c2Cl)nc1.
What is the InChIKey of (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
The InChIKey is ORDUBTFRJHUXLP-JTQLQIEISA-N. The full InChI is InChI=1S/C15H14Cl2N2O2/c1-9-6-7-13(18-8-9)19-15(20)10(2)21-12-5-3-4-11(16)14(12)17/h3-8,10H,1-2H3,(H,18,19,20)/t10-/m0/s1.
What are the key properties of (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
(2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide has a molecular weight of 325.20 g/mol, XLogP of 4.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 27233794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).