2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide

C18H19Cl2NO3 — CID 124669662

IUPAC2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide
SMILESCC[C@H](CO)NC(=O)c1ccccc1OCc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H19Cl2NO3/c1-2-14(10-22)21-18(23)15-5-3-4-6-17(15)24-11-12-7-8-13(19)9-16(12)20/h3-9,14,22H,2,10-11H2,1H3,(H,21,23)/t14-/m1/s1
InChIKeyHNHGWLKJSGBXBN-CQSZACIVSA-N
MW368.26 g/mol
LogP4.07
Rot. Bonds7

About 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide

2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide (PubChem CID 124669662) has the molecular formula C18H19Cl2NO3 and a molecular weight of 368.26 g/mol. Its IUPAC name is 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide.

Molecular Properties

Compound Name2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide
PubChem CID124669662
Molecular FormulaC18H19Cl2NO3
Molecular Weight368.26 g/mol
Exact Mass367.07
IUPAC Name2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide
SMILESCC[C@H](CO)NC(=O)c1ccccc1OCc1ccc(Cl)cc1Cl
InChIInChI=1S/C18H19Cl2NO3/c1-2-14(10-22)21-18(23)15-5-3-4-6-17(15)24-11-12-7-8-13(19)9-16(12)20/h3-9,14,22H,2,10-11H2,1H3,(H,21,23)/t14-/m1/s1
InChIKeyHNHGWLKJSGBXBN-CQSZACIVSA-N
XLogP4.07
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.26
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
The IUPAC name of 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide (CID 124669662) is 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide.
What is the SMILES notation for 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
The canonical SMILES for 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide is CC[C@H](CO)NC(=O)c1ccccc1OCc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
The InChIKey is HNHGWLKJSGBXBN-CQSZACIVSA-N. The full InChI is InChI=1S/C18H19Cl2NO3/c1-2-14(10-22)21-18(23)15-5-3-4-6-17(15)24-11-12-7-8-13(19)9-16(12)20/h3-9,14,22H,2,10-11H2,1H3,(H,21,23)/t14-/m1/s1.
What are the key properties of 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide?
2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide has a molecular weight of 368.26 g/mol, XLogP of 4.07, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dichlorophenyl)methoxy]-N-[(2R)-1-hydroxybutan-2-yl]benzamide is sourced from PubChem (CID 124669662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).