2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide

C15H10Cl2N2O3 — CID 37091055

IUPAC2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)Nc1ccc2oc(=O)[nH]c2c1
InChIInChI=1S/C15H10Cl2N2O3/c16-9-2-1-8(11(17)6-9)5-14(20)18-10-3-4-13-12(7-10)19-15(21)22-13/h1-4,6-7H,5H2,(H,18,20)(H,19,21)
InChIKeyAAHLIYVBBMPWEG-UHFFFAOYSA-N
MW337.16 g/mol
LogP3.61
Rot. Bonds3

About 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide

2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide (PubChem CID 37091055) has the molecular formula C15H10Cl2N2O3 and a molecular weight of 337.16 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
PubChem CID37091055
Molecular FormulaC15H10Cl2N2O3
Molecular Weight337.16 g/mol
Exact Mass336.01
IUPAC Name2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1Cl)Nc1ccc2oc(=O)[nH]c2c1
InChIInChI=1S/C15H10Cl2N2O3/c16-9-2-1-8(11(17)6-9)5-14(20)18-10-3-4-13-12(7-10)19-15(21)22-13/h1-4,6-7H,5H2,(H,18,20)(H,19,21)
InChIKeyAAHLIYVBBMPWEG-UHFFFAOYSA-N
XLogP3.61
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.16
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-oxo-4-[(2-oxo-3H-1,3-benzoxazol-5-yl)amino]butanoic acid
CID 12925401
5-chloro-N-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide
CID 134019812
5-[(2-bromo-5-chlorophenyl)methylamino]-3H-1,3-benzoxazol-2-one
CID 66160922
2-(3,4-difluorophenyl)sulfanyl-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide
CID 134019807
N-(2-oxo-3H-1,3-benzoxazol-5-yl)-2-(2-propan-2-yloxyphenyl)acetamide
CID 166190370
2-amino-4-oxo-4-[(2-oxo-3H-1,3-benzoxazol-5-yl)amino]butanoic acid
CID 115180967
methyl 4-oxo-4-[(2-oxo-3H-1,3-benzoxazol-5-yl)amino]butanoate
CID 47157162
N-(2-oxo-3H-1,3-benzoxazol-5-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 134019747
1-(4-chlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)cyclopentane-1-carboxamide
CID 134019851
2-(2,4-dichlorophenyl)-N-(4-methylphenyl)acetamide
CID 2712173
3-acetamido-N-(2-oxo-3H-1,3-benzoxazol-5-yl)propanamide
CID 47160045
2-(2,4-dichlorophenyl)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 46553550

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide (CID 37091055) is 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide is O=C(Cc1ccc(Cl)cc1Cl)Nc1ccc2oc(=O)[nH]c2c1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide?
The InChIKey is AAHLIYVBBMPWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O3/c16-9-2-1-8(11(17)6-9)5-14(20)18-10-3-4-13-12(7-10)19-15(21)22-13/h1-4,6-7H,5H2,(H,18,20)(H,19,21).
What are the key properties of 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide?
2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide has a molecular weight of 337.16 g/mol, XLogP of 3.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-(2-oxo-3H-1,3-benzoxazol-5-yl)acetamide is sourced from PubChem (CID 37091055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).