N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide

C15H14Cl2N2O2 — CID 86996582

IUPACN-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide
SMILESCC(C)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1
InChIInChI=1S/C15H14Cl2N2O2/c1-9(2)14(20)19-11-3-5-12(6-4-11)21-15-13(17)7-10(16)8-18-15/h3-9H,1-2H3,(H,19,20)
InChIKeyRCMRNTOIRPDZNR-UHFFFAOYSA-N
MW325.20 g/mol
LogP4.78
Rot. Bonds4

About N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide

N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide (PubChem CID 86996582) has the molecular formula C15H14Cl2N2O2 and a molecular weight of 325.20 g/mol. Its IUPAC name is N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide
PubChem CID86996582
Molecular FormulaC15H14Cl2N2O2
Molecular Weight325.20 g/mol
Exact Mass324.04
IUPAC NameN-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide
SMILESCC(C)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1
InChIInChI=1S/C15H14Cl2N2O2/c1-9(2)14(20)19-11-3-5-12(6-4-11)21-15-13(17)7-10(16)8-18-15/h3-9H,1-2H3,(H,19,20)
InChIKeyRCMRNTOIRPDZNR-UHFFFAOYSA-N
XLogP4.78
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 ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethoxy)-N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]acetamide
CID 86996577
2-(cyclopropylmethylamino)-N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]acetamide;dihydrochloride
CID 119858054
5-chloro-2-[4-(2-methylpropanoylamino)phenoxy]benzoic acid
CID 20648118
N-[4-[2-(4-chlorophenoxy)propanoylamino]phenyl]-2-methylpropanamide
CID 17187935
N-[4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]phenyl]-2-methylpropanamide
CID 1293450
3-amino-N-[4-[(5-chloro-2-pyridinyl)oxy]phenyl]-2-methylbutanamide
CID 120503351
[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl] formate
CID 87870610
1-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-N-methylmethanamine
CID 106486635
[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl] N-butylcarbamate
CID 23635766
(2R)-2-(2,4-dichlorophenoxy)-N-(4-methoxyphenyl)propanamide
CID 697237
3,5-dichloro-2-(3-chlorophenoxy)pyridine
CID 91013057
2-chloro-4-[(3,5-dichloro-2-pyridinyl)oxy]phenol
CID 86116326

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide?
The IUPAC name of N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide (CID 86996582) is N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide?
The canonical SMILES for N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide is CC(C)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1.
What is the InChIKey of N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide?
The InChIKey is RCMRNTOIRPDZNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2/c1-9(2)14(20)19-11-3-5-12(6-4-11)21-15-13(17)7-10(16)8-18-15/h3-9H,1-2H3,(H,19,20).
What are the key properties of N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide?
N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide has a molecular weight of 325.20 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-methylpropanamide is sourced from PubChem (CID 86996582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).