N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide

C11H11Cl2NO2 — CID 110476456

IUPACN-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide
SMILESO=C(CC1COC1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C11H11Cl2NO2/c12-8-1-2-9(13)10(4-8)14-11(15)3-7-5-16-6-7/h1-2,4,7H,3,5-6H2,(H,14,15)
InChIKeyDNKAANIZPAYCSY-UHFFFAOYSA-N
MW260.12 g/mol
LogP2.97
Rot. Bonds3

About N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide

N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide (PubChem CID 110476456) has the molecular formula C11H11Cl2NO2 and a molecular weight of 260.12 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide
PubChem CID110476456
Molecular FormulaC11H11Cl2NO2
Molecular Weight260.12 g/mol
Exact Mass259.02
IUPAC NameN-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide
SMILESO=C(CC1COC1)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C11H11Cl2NO2/c12-8-1-2-9(13)10(4-8)14-11(15)3-7-5-16-6-7/h1-2,4,7H,3,5-6H2,(H,14,15)
InChIKeyDNKAANIZPAYCSY-UHFFFAOYSA-N
XLogP2.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.12
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-N-(2,5-dichlorophenyl)acetamide
CID 7733768
N-(2,4-dichlorophenyl)-2-(oxan-3-yl)acetamide
CID 110864058
N-(2,5-dichlorophenyl)-3-hydroxypropanamide
CID 43558723
N-(5-bromo-2-chlorophenyl)-2-cyclobutylacetamide
CID 103707266
[4-chloro-2-[(2-cyclopropylacetyl)amino]phenyl]boronic acid
CID 164645579
3-cyclohexylsulfanyl-N-(2,5-dichlorophenyl)propanamide
CID 23804460
N-(2,5-dichlorophenyl)-2-methylsulfanylacetamide
CID 47097975
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(oxan-3-yl)acetamide
CID 110863811
2-(azetidin-3-ylmethylsulfanyl)-N-(2,5-dichlorophenyl)acetamide
CID 66289696
N-(2-amino-5-chlorophenyl)-2-cycloheptylacetamide
CID 114457006
N-(5-amino-2-chlorophenyl)-2-cyclohexylacetamide
CID 43548756
2-[(5R)-2-(diaminomethylideneamino)-4-oxo-1,3-thiazol-5-yl]-N-(2,5-dichlorophenyl)acetamide
CID 29102657

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide (CID 110476456) is N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide is O=C(CC1COC1)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide?
The InChIKey is DNKAANIZPAYCSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2NO2/c12-8-1-2-9(13)10(4-8)14-11(15)3-7-5-16-6-7/h1-2,4,7H,3,5-6H2,(H,14,15).
What are the key properties of N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide?
N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide has a molecular weight of 260.12 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(oxetan-3-yl)acetamide is sourced from PubChem (CID 110476456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).