N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide

C20H14ClNO3 — CID 88886136

IUPACN-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide
SMILESO=CNc1ccc(Cl)cc1C(=O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C20H14ClNO3/c21-14-10-11-18(22-13-23)17(12-14)20(24)16-8-4-5-9-19(16)25-15-6-2-1-3-7-15/h1-13H,(H,22,23)
InChIKeyVZZDEFUTVVSDOV-UHFFFAOYSA-N
MW351.79 g/mol
LogP4.93
Rot. Bonds6

About N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide

N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide (PubChem CID 88886136) has the molecular formula C20H14ClNO3 and a molecular weight of 351.79 g/mol. Its IUPAC name is N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide.

Molecular Properties

Compound NameN-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide
PubChem CID88886136
Molecular FormulaC20H14ClNO3
Molecular Weight351.79 g/mol
Exact Mass351.07
IUPAC NameN-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide
SMILESO=CNc1ccc(Cl)cc1C(=O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C20H14ClNO3/c21-14-10-11-18(22-13-23)17(12-14)20(24)16-8-4-5-9-19(16)25-15-6-2-1-3-7-15/h1-13H,(H,22,23)
InChIKeyVZZDEFUTVVSDOV-UHFFFAOYSA-N
XLogP4.93
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.79
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[4-chloro-2-(2-ethoxy-5-fluorobenzoyl)phenyl]formamide
CID 87294357
N-[5-chloro-2-(3-fluorophenoxy)phenyl]formamide
CID 168652553
N-[4-chloro-2-[(Z)-N-hydroxy-C-phenylcarbonimidoyl]phenyl]formamide
CID 6522385
(2-phenoxyphenyl)-phenylmethanone
CID 10802273
N-(2-benzoyl-4-fluorophenyl)formamide
CID 168651173
N-(5-methyl-2-phenoxyphenyl)formamide
CID 2336214
2-(3-chlorophenoxy)benzoyl bromide
CID 139662791
ethyl 5-chloro-2-phenoxybenzoate
CID 11652014
4-chloro-2-formamidobenzoic acid
CID 61146469
N-[2-(4-fluorophenoxy)phenyl]formamide
CID 86192955
N-(5-chloro-2-phenoxyphenyl)benzamide
CID 956230
5-amino-2-(5-chloro-2-phenoxyanilino)benzamide
CID 100654576

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide?
The IUPAC name of N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide (CID 88886136) is N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide.
What is the SMILES notation for N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide?
The canonical SMILES for N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide is O=CNc1ccc(Cl)cc1C(=O)c1ccccc1Oc1ccccc1.
What is the InChIKey of N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide?
The InChIKey is VZZDEFUTVVSDOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClNO3/c21-14-10-11-18(22-13-23)17(12-14)20(24)16-8-4-5-9-19(16)25-15-6-2-1-3-7-15/h1-13H,(H,22,23).
What are the key properties of N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide?
N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide has a molecular weight of 351.79 g/mol, XLogP of 4.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-2-(2-phenoxybenzoyl)phenyl]formamide is sourced from PubChem (CID 88886136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).