3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide

C15H12ClNO2 — CID 151114829

IUPAC3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide
SMILESO=C(C=Cc1cc(Cl)ccc1-c1ccccc1)NO
InChIInChI=1S/C15H12ClNO2/c16-13-7-8-14(11-4-2-1-3-5-11)12(10-13)6-9-15(18)17-19/h1-10,19H,(H,17,18)
InChIKeyMQXVTQVRLFONJX-UHFFFAOYSA-N
MW273.72 g/mol
LogP3.53
Rot. Bonds3

About 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide

3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide (PubChem CID 151114829) has the molecular formula C15H12ClNO2 and a molecular weight of 273.72 g/mol. Its IUPAC name is 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide.

Molecular Properties

Compound Name3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide
PubChem CID151114829
Molecular FormulaC15H12ClNO2
Molecular Weight273.72 g/mol
Exact Mass273.06
IUPAC Name3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide
SMILESO=C(C=Cc1cc(Cl)ccc1-c1ccccc1)NO
InChIInChI=1S/C15H12ClNO2/c16-13-7-8-14(11-4-2-1-3-5-11)12(10-13)6-9-15(18)17-19/h1-10,19H,(H,17,18)
InChIKeyMQXVTQVRLFONJX-UHFFFAOYSA-N
XLogP3.53
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.72
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(1E,6E)-1-(5-chloro-2-phenylphenyl)-7-(4-hydroxyphenyl)hepta-1,6-diene-3,5-dione
CID 67106716
(E)-3-(4-chloro-2-methylphenyl)-N-hydroxyprop-2-enamide
CID 24860349
N-hydroxy-5-(2-phenylphenyl)penta-2,4-dienamide
CID 173095645
(E)-3-(4-chloro-2-cyanophenyl)-N-hydroxyprop-2-enamide
CID 24860354
3-(2-chlorophenyl)-N-(2,4-dichlorophenyl)prop-2-enamide
CID 966049
(E)-3-(4-chloro-2-methylsulfonylphenyl)-N-hydroxyprop-2-enamide
CID 24860353
5-chloro-2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]amino]benzoic acid
CID 23292165
5-chloro-2-[3-(4-phenylphenyl)prop-2-enoylamino]benzoic acid
CID 66680842
(E)-N-(2-benzoyl-4-chlorophenyl)-3-(2-chlorophenyl)prop-2-enamide
CID 6121168
(E)-3-[2-chloro-4-(3-fluorophenyl)phenyl]-N-hydroxyprop-2-enamide
CID 70692229
N-(5-chloro-2-phenylphenyl)acetamide
CID 11425106
3-chloro-N'-[(Z)-3-phenylprop-2-enoyl]benzohydrazide
CID 2166903

Frequently Asked Questions

What is the IUPAC name of 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide?
The IUPAC name of 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide (CID 151114829) is 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide.
What is the SMILES notation for 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide?
The canonical SMILES for 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide is O=C(C=Cc1cc(Cl)ccc1-c1ccccc1)NO.
What is the InChIKey of 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide?
The InChIKey is MQXVTQVRLFONJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClNO2/c16-13-7-8-14(11-4-2-1-3-5-11)12(10-13)6-9-15(18)17-19/h1-10,19H,(H,17,18).
What are the key properties of 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide?
3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide has a molecular weight of 273.72 g/mol, XLogP of 3.53, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chloro-2-phenylphenyl)-N-hydroxyprop-2-enamide is sourced from PubChem (CID 151114829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).