N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide

C19H15ClN2O3 — CID 29204883

IUPACN-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)c(Cl)c1
InChIInChI=1S/C19H15ClN2O3/c1-12-4-9-16(15(20)11-12)22-18(23)13-5-7-14(8-6-13)21-19(24)17-3-2-10-25-17/h2-11H,1H3,(H,21,24)(H,22,23)
InChIKeyYTWJSJKGESGCFY-UHFFFAOYSA-N
MW354.79 g/mol
LogP4.75
Rot. Bonds4

About N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide

N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 29204883) has the molecular formula C19H15ClN2O3 and a molecular weight of 354.79 g/mol. Its IUPAC name is N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
PubChem CID29204883
Molecular FormulaC19H15ClN2O3
Molecular Weight354.79 g/mol
Exact Mass354.08
IUPAC NameN-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)c(Cl)c1
InChIInChI=1S/C19H15ClN2O3/c1-12-4-9-16(15(20)11-12)22-18(23)13-5-7-14(8-6-13)21-19(24)17-3-2-10-25-17/h2-11H,1H3,(H,21,24)(H,22,23)
InChIKeyYTWJSJKGESGCFY-UHFFFAOYSA-N
XLogP4.75
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.79
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-chloro-4-[(3,4-dimethylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1365415
N-[4-[(4-benzamido-3-chlorophenyl)carbamothioylamino]phenyl]furan-2-carboxamide
CID 57248454
N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 823701
N-[4-[(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)carbamoyl]phenyl]furan-2-carboxamide
CID 46461915
N-[4-[(2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 872367
N-[2-chloro-4-[(3-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 171982278
N-[4-[(4-fluoro-2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 9426257
N-[4-methoxy-3-[(4-methylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 655668
N-[2-chloro-4-[(2-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 4308074
N-[2-chloro-4-[(4-methylphenyl)methylcarbamoylamino]phenyl]furan-2-carboxamide
CID 60544197
N-(2,4-dichlorophenyl)furan-2-carboxamide
CID 3105425
N-[2-[(4-methoxybenzoyl)amino]-4-methylphenyl]furan-2-carboxamide
CID 25250119

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide (CID 29204883) is N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide is Cc1ccc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)c(Cl)c1.
What is the InChIKey of N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is YTWJSJKGESGCFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O3/c1-12-4-9-16(15(20)11-12)22-18(23)13-5-7-14(8-6-13)21-19(24)17-3-2-10-25-17/h2-11H,1H3,(H,21,24)(H,22,23).
What are the key properties of N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide?
N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 354.79 g/mol, XLogP of 4.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-chloro-4-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 29204883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).