N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide

C19H15ClN2O3 — CID 46671768

IUPACN-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESO=C(NCc1cccc(Cl)c1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C19H15ClN2O3/c20-15-4-1-3-13(11-15)12-21-18(23)14-6-8-16(9-7-14)22-19(24)17-5-2-10-25-17/h1-11H,12H2,(H,21,23)(H,22,24)
InChIKeyZCBQUPMVBMFZDY-UHFFFAOYSA-N
MW354.79 g/mol
LogP4.12
Rot. Bonds5

About N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide

N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide (PubChem CID 46671768) has the molecular formula C19H15ClN2O3 and a molecular weight of 354.79 g/mol. Its IUPAC name is N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
PubChem CID46671768
Molecular FormulaC19H15ClN2O3
Molecular Weight354.79 g/mol
Exact Mass354.08
IUPAC NameN-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESO=C(NCc1cccc(Cl)c1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C19H15ClN2O3/c20-15-4-1-3-13(11-15)12-21-18(23)14-6-8-16(9-7-14)22-19(24)17-5-2-10-25-17/h1-11H,12H2,(H,21,23)(H,22,24)
InChIKeyZCBQUPMVBMFZDY-UHFFFAOYSA-N
XLogP4.12
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.79
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[(3-chlorophenyl)methylcarbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 51158750
N-[4-[(4-acetamidophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24628897
N-[4-(furan-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 976453
N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 823701
1-(3-chlorophenyl)-N-[[4-(furan-2-carbonylamino)phenyl]methyl]pyrazole-4-carboxamide
CID 55871353
N-[4-[[[4-(2-phenylethynyl)benzoyl]amino]methyl]phenyl]furan-2-carboxamide
CID 24618603
N-[3-[[(4-chloro-2-iodobenzoyl)amino]methyl]phenyl]furan-2-carboxamide
CID 46453642
N-[3-[[(4-propan-2-yloxybenzoyl)amino]methyl]phenyl]furan-2-carboxamide
CID 39228978
N-[[4-(furan-2-carbonylamino)phenyl]methyl]-1-oxidopyridin-1-ium-4-carboxamide
CID 42018045
N-[4-[(2-methylphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 9184242
N-[4-[(4-propan-2-yloxyphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 55589199
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide (CID 46671768) is N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide is O=C(NCc1cccc(Cl)c1)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is ZCBQUPMVBMFZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O3/c20-15-4-1-3-13(11-15)12-21-18(23)14-6-8-16(9-7-14)22-19(24)17-5-2-10-25-17/h1-11H,12H2,(H,21,23)(H,22,24).
What are the key properties of N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide?
N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 354.79 g/mol, XLogP of 4.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-chlorophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 46671768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).