N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide

C15H10Cl2F2N2O3 — CID 54288472

IUPACN-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide
SMILESCOc1c(Cl)cc(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl
InChIInChI=1S/C15H10Cl2F2N2O3/c1-24-13-8(16)5-7(6-9(13)17)20-15(23)21-14(22)12-10(18)3-2-4-11(12)19/h2-6H,1H3,(H2,20,21,22,23)
InChIKeyRVVLRUUDSJFFHF-UHFFFAOYSA-N
MW375.16 g/mol
LogP4.24
Rot. Bonds3

About N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide

N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide (PubChem CID 54288472) has the molecular formula C15H10Cl2F2N2O3 and a molecular weight of 375.16 g/mol. Its IUPAC name is N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide.

Molecular Properties

Compound NameN-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide
PubChem CID54288472
Molecular FormulaC15H10Cl2F2N2O3
Molecular Weight375.16 g/mol
Exact Mass374.00
IUPAC NameN-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide
SMILESCOc1c(Cl)cc(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl
InChIInChI=1S/C15H10Cl2F2N2O3/c1-24-13-8(16)5-7(6-9(13)17)20-15(23)21-14(22)12-10(18)3-2-4-11(12)19/h2-6H,1H3,(H2,20,21,22,23)
InChIKeyRVVLRUUDSJFFHF-UHFFFAOYSA-N
XLogP4.24
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.16
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-chloro-4-methylphenyl)carbamoyl]-2,6-difluorobenzamide
CID 23276007
2,6-difluoro-N-[(3-methoxyphenyl)carbamoyl]benzamide
CID 15740316
N-[[3,5-dichloro-4-(2-phenylphenoxy)phenyl]carbamoyl]-2,6-difluorobenzamide
CID 70402586
N-[(4-chloro-3-methylphenyl)carbamoyl]-2,6-difluorobenzamide
CID 23276006
N-[[4-(3,4-dichlorophenyl)-3-methoxyphenyl]carbamoyl]-2,6-difluorobenzamide
CID 134117338
N-[[4-(4-chloronaphthalen-1-yl)oxy-3,5-dimethylphenyl]carbamoyl]-2,6-difluorobenzamide
CID 13262079
N-[[3,5-dichloro-4-(1-cyclohexylbutoxy)phenyl]carbamoyl]-2,6-difluorobenzamide
CID 21285673
N-[(3,5-dichloro-4-pyrazol-1-ylphenyl)carbamoyl]-2,6-difluorobenzamide
CID 14370440
N-[[3-chloro-4-[1-(4-chlorophenyl)ethoxy]phenyl]carbamoyl]-2,6-difluorobenzamide
CID 20524417
N-[[3,5-dichloro-4-(4-nitro-2-phenylphenoxy)phenyl]carbamoyl]-2,6-difluorobenzamide
CID 19072689
2,6-difluoro-N-[[4-(1,1,2,2,3,3,3-heptafluoropropyl)-3-methoxyphenyl]carbamoyl]benzamide
CID 134101620
2,6-difluoro-N-[[3-methoxy-4-(4-methoxyphenyl)phenyl]carbamoyl]benzamide
CID 15452397

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide?
The IUPAC name of N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide (CID 54288472) is N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide.
What is the SMILES notation for N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide?
The canonical SMILES for N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide is COc1c(Cl)cc(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl.
What is the InChIKey of N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide?
The InChIKey is RVVLRUUDSJFFHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2F2N2O3/c1-24-13-8(16)5-7(6-9(13)17)20-15(23)21-14(22)12-10(18)3-2-4-11(12)19/h2-6H,1H3,(H2,20,21,22,23).
What are the key properties of N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide?
N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide has a molecular weight of 375.16 g/mol, XLogP of 4.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide is sourced from PubChem (CID 54288472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).