4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide

C19H14Cl2FNO2 — CID 19120087

IUPAC4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide
SMILESO=C(c1ccc(Cl)cc1)N(Cc1ccco1)Cc1c(F)cccc1Cl
InChIInChI=1S/C19H14Cl2FNO2/c20-14-8-6-13(7-9-14)19(24)23(11-15-3-2-10-25-15)12-16-17(21)4-1-5-18(16)22/h1-10H,11-12H2
InChIKeyRZQCZCZZYWSATQ-UHFFFAOYSA-N
MW378.23 g/mol
LogP5.57
Rot. Bonds5

About 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide

4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide (PubChem CID 19120087) has the molecular formula C19H14Cl2FNO2 and a molecular weight of 378.23 g/mol. Its IUPAC name is 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide
PubChem CID19120087
Molecular FormulaC19H14Cl2FNO2
Molecular Weight378.23 g/mol
Exact Mass377.04
IUPAC Name4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide
SMILESO=C(c1ccc(Cl)cc1)N(Cc1ccco1)Cc1c(F)cccc1Cl
InChIInChI=1S/C19H14Cl2FNO2/c20-14-8-6-13(7-9-14)19(24)23(11-15-3-2-10-25-15)12-16-17(21)4-1-5-18(16)22/h1-10H,11-12H2
InChIKeyRZQCZCZZYWSATQ-UHFFFAOYSA-N
XLogP5.57
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.23
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-butoxy-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide
CID 19120118
3,4-dichloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-1-benzothiophene-2-carboxamide
CID 19120207
N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-3-methyl-1-benzofuran-2-carboxamide
CID 19120210
N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-2-(2,3,4,5,6-pentafluorophenoxy)acetamide
CID 19120148
N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19120147
2-(4-chloro-3,5-dimethylphenoxy)-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide
CID 19120130
2-chloro-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide
CID 17012308
N-benzyl-3-chloro-N-(furan-2-ylmethyl)benzamide
CID 772869
2-(2-chloro-6-fluorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 2161159
2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 56724069
4-fluoro-N-(furan-2-ylmethyl)-N-[(2-hydroxyphenyl)methyl]benzamide
CID 78798694
3-[(2-chloro-6-fluorophenyl)methyl-(furan-2-ylmethyl)amino]propanenitrile
CID 78823683

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide (CID 19120087) is 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide is O=C(c1ccc(Cl)cc1)N(Cc1ccco1)Cc1c(F)cccc1Cl.
What is the InChIKey of 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is RZQCZCZZYWSATQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2FNO2/c20-14-8-6-13(7-9-14)19(24)23(11-15-3-2-10-25-15)12-16-17(21)4-1-5-18(16)22/h1-10H,11-12H2.
What are the key properties of 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide?
4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 378.23 g/mol, XLogP of 5.57, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 19120087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).