2-(2,5-dichlorophenoxy)butanamide

C10H11Cl2NO2 — CID 62901251

IUPAC2-(2,5-dichlorophenoxy)butanamide
SMILESCCC(Oc1cc(Cl)ccc1Cl)C(N)=O
InChIInChI=1S/C10H11Cl2NO2/c1-2-8(10(13)14)15-9-5-6(11)3-4-7(9)12/h3-5,8H,2H2,1H3,(H2,13,14)
InChIKeyTUDWFVAXNIWQNS-UHFFFAOYSA-N
MW248.11 g/mol
LogP2.64
Rot. Bonds4

About 2-(2,5-dichlorophenoxy)butanamide

2-(2,5-dichlorophenoxy)butanamide (PubChem CID 62901251) has the molecular formula C10H11Cl2NO2 and a molecular weight of 248.11 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)butanamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)butanamide
PubChem CID62901251
Molecular FormulaC10H11Cl2NO2
Molecular Weight248.11 g/mol
Exact Mass247.02
IUPAC Name2-(2,5-dichlorophenoxy)butanamide
SMILESCCC(Oc1cc(Cl)ccc1Cl)C(N)=O
InChIInChI=1S/C10H11Cl2NO2/c1-2-8(10(13)14)15-9-5-6(11)3-4-7(9)12/h3-5,8H,2H2,1H3,(H2,13,14)
InChIKeyTUDWFVAXNIWQNS-UHFFFAOYSA-N
XLogP2.64
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.11
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-carbamothioyl-5-chlorophenoxy)butanamide
CID 113277371
ethyl 2-(2,5-dichlorophenoxy)pentanoate
CID 83038151
2-(1-amino-1-oxobutan-2-yl)oxy-5-chlorobenzenesulfonyl chloride
CID 82922031
methyl 2-(2,5-dichlorophenoxy)hexanoate
CID 113373433
2-[4-chloro-2-[1-(ethylamino)ethyl]phenoxy]butanamide
CID 55132194
(2S)-3-amino-2-(2,5-dichlorophenoxy)propanoic acid;hydrochloride
CID 68946272
4-(1-amino-1-oxobutan-2-yl)oxy-3-chlorobenzoic acid
CID 62900576
2-[2-[(tert-butylamino)methyl]-4-chlorophenoxy]butanamide
CID 63056882
(2,5-dichlorophenyl) 2-ethylbutanoate
CID 91695920
3-(2,5-dichlorophenoxy)pentanethioamide
CID 43175286
ethyl (2R)-2-(2-chloro-5-methylphenoxy)butanoate
CID 40613985
4-[2-[2-(2,5-dichlorophenoxy)butanoyl]hydrazinyl]-4-oxobutanoic acid
CID 4252186

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)butanamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)butanamide (CID 62901251) is 2-(2,5-dichlorophenoxy)butanamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)butanamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)butanamide is CCC(Oc1cc(Cl)ccc1Cl)C(N)=O.
What is the InChIKey of 2-(2,5-dichlorophenoxy)butanamide?
The InChIKey is TUDWFVAXNIWQNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2NO2/c1-2-8(10(13)14)15-9-5-6(11)3-4-7(9)12/h3-5,8H,2H2,1H3,(H2,13,14).
What are the key properties of 2-(2,5-dichlorophenoxy)butanamide?
2-(2,5-dichlorophenoxy)butanamide has a molecular weight of 248.11 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenoxy)butanamide is sourced from PubChem (CID 62901251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).