N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide

C18H13Cl2NO2 — CID 16651378

IUPACN-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(Cl)cc2)cc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C18H13Cl2NO2/c1-11-16(18(22)21-15-4-2-3-14(20)9-15)10-17(23-11)12-5-7-13(19)8-6-12/h2-10H,1H3,(H,21,22)
InChIKeyCXZARJDRIKEURQ-UHFFFAOYSA-N
MW346.21 g/mol
LogP5.81
Rot. Bonds3

About N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide

N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide (PubChem CID 16651378) has the molecular formula C18H13Cl2NO2 and a molecular weight of 346.21 g/mol. Its IUPAC name is N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
PubChem CID16651378
Molecular FormulaC18H13Cl2NO2
Molecular Weight346.21 g/mol
Exact Mass345.03
IUPAC NameN-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(Cl)cc2)cc1C(=O)Nc1cccc(Cl)c1
InChIInChI=1S/C18H13Cl2NO2/c1-11-16(18(22)21-15-4-2-3-14(20)9-15)10-17(23-11)12-5-7-13(19)8-6-12/h2-10H,1H3,(H,21,22)
InChIKeyCXZARJDRIKEURQ-UHFFFAOYSA-N
XLogP5.81
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.21
LogP ≤ 55.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-chlorophenyl)-N-(3-fluorophenyl)-2-methylfuran-3-carboxamide
CID 16651382
N-(2-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 2742801
2-methyl-N,5-bis(4-methylphenyl)furan-3-carboxamide
CID 16650715
5-(3,5-dichlorophenyl)-2-methyl-N-(3-nitrophenyl)furan-3-carboxamide
CID 2215470
5-(4-chlorophenyl)-N-(2-hydroxyethyl)-2-methylfuran-3-carboxamide
CID 16651453
ethyl 2-[[5-(4-chlorophenyl)-2-methylfuran-3-carbonyl]amino]benzoate
CID 16651463
N-(2,4-dichlorophenyl)-5-(3,4-dichlorophenyl)-2-methylfuran-3-carboxamide
CID 18809187
N-(4-carbamoylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 17015561
N-(4-bromophenyl)-5-(3,5-dichlorophenyl)-2-methylfuran-3-carboxamide
CID 18808826
5-(4-chlorophenyl)-2-methyl-N-(2-phenylethyl)furan-3-carboxamide
CID 16651429
N-(4-iodophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 1340506
N-(3-chlorophenyl)-1,2,5-trimethylpyrrole-3-carboxamide
CID 110691306

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide (CID 16651378) is N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide is Cc1oc(-c2ccc(Cl)cc2)cc1C(=O)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide?
The InChIKey is CXZARJDRIKEURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2NO2/c1-11-16(18(22)21-15-4-2-3-14(20)9-15)10-17(23-11)12-5-7-13(19)8-6-12/h2-10H,1H3,(H,21,22).
What are the key properties of N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide?
N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide has a molecular weight of 346.21 g/mol, XLogP of 5.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 16651378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).