2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide

C15H13Cl2NO2 — CID 91676947

IUPAC2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide
SMILESCC(O)c1cccc(NC(=O)c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-9(19)10-3-2-4-12(7-10)18-15(20)13-8-11(16)5-6-14(13)17/h2-9,19H,1H3,(H,18,20)
InChIKeyMGVJFUFSISMSKK-UHFFFAOYSA-N
MW310.18 g/mol
LogP4.30
Rot. Bonds3

About 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide

2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide (PubChem CID 91676947) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide
PubChem CID91676947
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide
SMILESCC(O)c1cccc(NC(=O)c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-9(19)10-3-2-4-12(7-10)18-15(20)13-8-11(16)5-6-14(13)17/h2-9,19H,1H3,(H,18,20)
InChIKeyMGVJFUFSISMSKK-UHFFFAOYSA-N
XLogP4.30
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[3-(1-hydroxyethyl)phenyl]-2-methoxybenzamide
CID 11841436
3-chloro-N-[3-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 27209859
4-amino-2-chloro-N-[3-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 100803624
4-chloro-2-fluoro-N-(3-propan-2-ylphenyl)benzamide
CID 27162860
3-chloro-N-[3-(1-hydroxyethyl)phenyl]-4-methylbenzamide
CID 91676950
2,5-dichloro-N-(3-chloro-4-fluorophenyl)benzamide
CID 690469
2-benzoyl-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 11841462
2,5-dibromo-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 11841390
4-chloro-N-[3-[(1R)-1-hydroxyethyl]phenyl]-3-nitrobenzamide
CID 100803593
N-[3-(bromomethyl)phenyl]-2,5-dichlorobenzamide
CID 114307198
2,5-dichloro-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]benzamide
CID 108933296
2,6-difluoro-N-[3-(1-hydroxyethyl)phenyl]-3-methylbenzamide
CID 82798846

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide?
The IUPAC name of 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide (CID 91676947) is 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide.
What is the SMILES notation for 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide?
The canonical SMILES for 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide is CC(O)c1cccc(NC(=O)c2cc(Cl)ccc2Cl)c1.
What is the InChIKey of 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide?
The InChIKey is MGVJFUFSISMSKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-9(19)10-3-2-4-12(7-10)18-15(20)13-8-11(16)5-6-14(13)17/h2-9,19H,1H3,(H,18,20).
What are the key properties of 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide?
2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide has a molecular weight of 310.18 g/mol, XLogP of 4.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[3-(1-hydroxyethyl)phenyl]benzamide is sourced from PubChem (CID 91676947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).