N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide

C18H14ClNO2 — CID 2742876

IUPACN-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide
SMILESCc1oc(-c2ccccc2)cc1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C18H14ClNO2/c1-12-14(11-17(22-12)13-7-3-2-4-8-13)18(21)20-16-10-6-5-9-15(16)19/h2-11H,1H3,(H,20,21)
InChIKeyMXSNUVXQMXZSKY-UHFFFAOYSA-N
MW311.77 g/mol
LogP5.16
Rot. Bonds3

About N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide

N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide (PubChem CID 2742876) has the molecular formula C18H14ClNO2 and a molecular weight of 311.77 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide
PubChem CID2742876
Molecular FormulaC18H14ClNO2
Molecular Weight311.77 g/mol
Exact Mass311.07
IUPAC NameN-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide
SMILESCc1oc(-c2ccccc2)cc1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C18H14ClNO2/c1-12-14(11-17(22-12)13-7-3-2-4-8-13)18(21)20-16-10-6-5-9-15(16)19/h2-11H,1H3,(H,20,21)
InChIKeyMXSNUVXQMXZSKY-UHFFFAOYSA-N
XLogP5.16
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.77
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 2742801
2-methyl-5-phenyl-N-[2-(trifluoromethyl)phenyl]furan-3-carboxamide
CID 16650690
N-(4-iodophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 1340506
methyl 2-[[5-(3,5-dichlorophenyl)-2-methylfuran-3-carbonyl]amino]benzoate
CID 2145557
N-(2-cyanophenyl)-5-(3,4-dichlorophenyl)-2-methylfuran-3-carboxamide
CID 18809184
ethyl 2-[[5-(4-chlorophenyl)-2-methylfuran-3-carbonyl]amino]benzoate
CID 16651463
N-(4-acetylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 16650627
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-(2-chloro-5-methoxyphenyl)-5-(4-fluorophenyl)-2-methylfuran-3-carboxamide
CID 16650857
2-(4-methylphenyl)-4-[(2-methyl-5-phenylfuran-3-carbonyl)amino]thiophene-3-carboxylic acid
CID 58191222
2-methyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-5-phenylfuran-3-carboxamide
CID 11530819

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide (CID 2742876) is N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide is Cc1oc(-c2ccccc2)cc1C(=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide?
The InChIKey is MXSNUVXQMXZSKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO2/c1-12-14(11-17(22-12)13-7-3-2-4-8-13)18(21)20-16-10-6-5-9-15(16)19/h2-11H,1H3,(H,20,21).
What are the key properties of N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide?
N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide has a molecular weight of 311.77 g/mol, XLogP of 5.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-methyl-5-phenylfuran-3-carboxamide is sourced from PubChem (CID 2742876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).