2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide

C15H14Cl2N2O2 — CID 112838920

IUPAC2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide
SMILESCc1cc(NC(=O)C(C)Oc2ccc(Cl)c(Cl)c2)ccn1
InChIInChI=1S/C15H14Cl2N2O2/c1-9-7-11(5-6-18-9)19-15(20)10(2)21-12-3-4-13(16)14(17)8-12/h3-8,10H,1-2H3,(H,18,19,20)
InChIKeyCGGLIMLUSGHJJV-UHFFFAOYSA-N
MW325.20 g/mol
LogP4.10
Rot. Bonds4

About 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide

2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide (PubChem CID 112838920) has the molecular formula C15H14Cl2N2O2 and a molecular weight of 325.20 g/mol. Its IUPAC name is 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide
PubChem CID112838920
Molecular FormulaC15H14Cl2N2O2
Molecular Weight325.20 g/mol
Exact Mass324.04
IUPAC Name2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide
SMILESCc1cc(NC(=O)C(C)Oc2ccc(Cl)c(Cl)c2)ccn1
InChIInChI=1S/C15H14Cl2N2O2/c1-9-7-11(5-6-18-9)19-15(20)10(2)21-12-3-4-13(16)14(17)8-12/h3-8,10H,1-2H3,(H,18,19,20)
InChIKeyCGGLIMLUSGHJJV-UHFFFAOYSA-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

2-(4-chloro-3-methylphenoxy)-N-(3,4-dichlorophenyl)propanamide
CID 53265973
(2S)-N-(3,4-dichlorophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 95077681
(2S)-N-(4-bromophenyl)-2-(3,4-dichlorophenoxy)propanamide
CID 7751387
(2R)-N-(3,4-dichlorophenyl)-2-(4-fluorophenoxy)propanamide
CID 40721189
(2R)-2-hydroxy-N-(2-methyl-4-pyridinyl)propanamide
CID 131207206
(2S)-N-(4-cyanophenyl)-2-(3,4-dichlorophenoxy)propanamide
CID 7433052
2-(4-chlorophenoxy)-N-pyridin-4-ylpropanamide
CID 51193889
2-(3,4-dichlorophenoxy)-N-(3-nitrophenyl)propanamide
CID 13052549
2-(3,4-dichlorophenoxy)-N-propan-2-ylpropanamide
CID 47109802
(2R)-2-(4-chloro-3-methylphenoxy)-N-(4-methyl-2-pyridinyl)propanamide
CID 7379498
2-(1,3-benzodioxol-5-yloxy)-N-(3,4-dichlorophenyl)propanamide
CID 45147837
2-(3,4-dichlorophenoxy)propanoic acid;ethane
CID 142915874

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide?
The IUPAC name of 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide (CID 112838920) is 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide.
What is the SMILES notation for 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide?
The canonical SMILES for 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide is Cc1cc(NC(=O)C(C)Oc2ccc(Cl)c(Cl)c2)ccn1.
What is the InChIKey of 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide?
The InChIKey is CGGLIMLUSGHJJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2/c1-9-7-11(5-6-18-9)19-15(20)10(2)21-12-3-4-13(16)14(17)8-12/h3-8,10H,1-2H3,(H,18,19,20).
What are the key properties of 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide?
2-(3,4-dichlorophenoxy)-N-(2-methyl-4-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 2-(3,4-dichlorophenoxy)-N-(2-methyl-4-pyridinyl)propanamide is sourced from PubChem (CID 112838920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).