N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide

C18H13ClN2O3 — CID 823701

IUPACN-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C18H13ClN2O3/c19-13-5-3-12(4-6-13)17(22)20-14-7-9-15(10-8-14)21-18(23)16-2-1-11-24-16/h1-11H,(H,20,22)(H,21,23)
InChIKeyUCINZOVGBCQRKF-UHFFFAOYSA-N
MW340.77 g/mol
LogP4.44
Rot. Bonds4

About N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide

N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide (PubChem CID 823701) has the molecular formula C18H13ClN2O3 and a molecular weight of 340.77 g/mol. Its IUPAC name is N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
PubChem CID823701
Molecular FormulaC18H13ClN2O3
Molecular Weight340.77 g/mol
Exact Mass340.06
IUPAC NameN-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C18H13ClN2O3/c19-13-5-3-12(4-6-13)17(22)20-14-7-9-15(10-8-14)21-18(23)16-2-1-11-24-16/h1-11H,(H,20,22)(H,21,23)
InChIKeyUCINZOVGBCQRKF-UHFFFAOYSA-N
XLogP4.44
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.77
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[4-[(4-chlorophenyl)sulfamoyl]benzoyl]amino]phenyl]furan-2-carboxamide
CID 42014553
[4-[(4-chlorobenzoyl)amino]phenyl] furan-2-carboxylate
CID 26190079
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[(Z)-1-[4-[(4-chlorobenzoyl)amino]phenyl]ethylideneamino]furan-2-carboxamide
CID 6007896
N-[4-[(4-propan-2-ylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1114254
N-[2-[(4-chlorophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 722967
N-[4-[(4-chlorophenyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide
CID 17403165
N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 46671768
N-[4-[3-(4-chlorophenyl)prop-2-enoylamino]phenyl]furan-2-carboxamide
CID 1015757
N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 29204883
N-[4-[(2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 872367
[4-(furan-2-carbonylamino)phenyl]carbamic acid
CID 18543126

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide (CID 823701) is N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide is O=C(Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Cl)cc1.
What is the InChIKey of N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide?
The InChIKey is UCINZOVGBCQRKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClN2O3/c19-13-5-3-12(4-6-13)17(22)20-14-7-9-15(10-8-14)21-18(23)16-2-1-11-24-16/h1-11H,(H,20,22)(H,21,23).
What are the key properties of N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide?
N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide has a molecular weight of 340.77 g/mol, XLogP of 4.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 823701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).