3-chloro-4-[(4-fluorophenyl)methoxy]benzamide

C14H11ClFNO2 — CID 91681954

IUPAC3-chloro-4-[(4-fluorophenyl)methoxy]benzamide
SMILESNC(=O)c1ccc(OCc2ccc(F)cc2)c(Cl)c1
InChIInChI=1S/C14H11ClFNO2/c15-12-7-10(14(17)18)3-6-13(12)19-8-9-1-4-11(16)5-2-9/h1-7H,8H2,(H2,17,18)
InChIKeyWOUVPTZIBYPLOS-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.16
Rot. Bonds4

About 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide

3-chloro-4-[(4-fluorophenyl)methoxy]benzamide (PubChem CID 91681954) has the molecular formula C14H11ClFNO2 and a molecular weight of 279.70 g/mol. Its IUPAC name is 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide.

Molecular Properties

Compound Name3-chloro-4-[(4-fluorophenyl)methoxy]benzamide
PubChem CID91681954
Molecular FormulaC14H11ClFNO2
Molecular Weight279.70 g/mol
Exact Mass279.05
IUPAC Name3-chloro-4-[(4-fluorophenyl)methoxy]benzamide
SMILESNC(=O)c1ccc(OCc2ccc(F)cc2)c(Cl)c1
InChIInChI=1S/C14H11ClFNO2/c15-12-7-10(14(17)18)3-6-13(12)19-8-9-1-4-11(16)5-2-9/h1-7H,8H2,(H2,17,18)
InChIKeyWOUVPTZIBYPLOS-UHFFFAOYSA-N
XLogP3.16
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2-chloro-4-fluorophenoxy)methyl]benzamide
CID 27313029
4-[(4-carbamoylphenyl)methoxy]-3-chlorobenzoic acid
CID 60711874
3-chloro-4-[(3,4-dichlorophenyl)methoxy]benzamide
CID 91683401
4-[(2-chloro-4-fluorophenoxy)methyl]benzohydrazide
CID 63576415
4-[(2-bromo-4-fluorophenoxy)methyl]benzamide
CID 24526653
(E)-3-[3-chloro-4-[(4-fluorophenyl)methoxy]phenyl]prop-2-enamide
CID 91684714
4-[(3-bromophenyl)methoxy]-3-chlorobenzamide
CID 91683338
CID 88897804
CID 88897804
2-[4-[(2-chloro-4-fluorophenoxy)methyl]phenyl]acetohydrazide
CID 105351476
[3-chloro-4-[(4-fluorophenyl)methoxy]phenyl]borane
CID 91869279
1-[3-chloro-4-[(4-chlorophenyl)methoxy]phenyl]ethanone
CID 65125936
3-[(4-fluorophenyl)methoxy]benzamide
CID 18354605

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide?
The IUPAC name of 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide (CID 91681954) is 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide.
What is the SMILES notation for 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide?
The canonical SMILES for 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide is NC(=O)c1ccc(OCc2ccc(F)cc2)c(Cl)c1.
What is the InChIKey of 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide?
The InChIKey is WOUVPTZIBYPLOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO2/c15-12-7-10(14(17)18)3-6-13(12)19-8-9-1-4-11(16)5-2-9/h1-7H,8H2,(H2,17,18).
What are the key properties of 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide?
3-chloro-4-[(4-fluorophenyl)methoxy]benzamide has a molecular weight of 279.70 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-[(4-fluorophenyl)methoxy]benzamide is sourced from PubChem (CID 91681954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).