N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide

C20H18N2O3 — CID 30797782

IUPACN-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide
SMILESO=C(NCCNC(=O)c1ccco1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H18N2O3/c23-19(21-12-13-22-20(24)18-7-4-14-25-18)17-10-8-16(9-11-17)15-5-2-1-3-6-15/h1-11,14H,12-13H2,(H,21,23)(H,22,24)
InChIKeyQBGONVWBCFBRNI-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.11
Rot. Bonds6

About N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide

N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide (PubChem CID 30797782) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide
PubChem CID30797782
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC NameN-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide
SMILESO=C(NCCNC(=O)c1ccco1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H18N2O3/c23-19(21-12-13-22-20(24)18-7-4-14-25-18)17-10-8-16(9-11-17)15-5-2-1-3-6-15/h1-11,14H,12-13H2,(H,21,23)(H,22,24)
InChIKeyQBGONVWBCFBRNI-UHFFFAOYSA-N
XLogP3.11
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[[2-[(4-phenylbenzoyl)amino]acetyl]amino]ethyl]furan-2-carboxamide
CID 33191879
N-[2-[[4-[[2-(4-phenylphenyl)acetyl]amino]benzoyl]amino]ethyl]furan-2-carboxamide
CID 121062816
N-[2-[(4-ethylbenzoyl)amino]ethyl]furan-2-carboxamide
CID 134052250
N-[2-[[4-(benzylcarbamoylamino)benzoyl]amino]ethyl]furan-2-carboxamide
CID 121062902
N-[3-(furan-2-yl)-3-hydroxypropyl]-4-phenylbenzamide
CID 71787703
N-[2-[(3,4-dichlorobenzoyl)amino]ethyl]furan-2-carboxamide
CID 6490902
N-[2-[(3,4,5-trihydroxybenzoyl)amino]ethyl]furan-2-carboxamide
CID 108538997
3-(furan-2-carbonylamino)propanoic acid
CID 762504
N-[10-(furan-2-carbonylamino)decyl]furan-2-carboxamide
CID 3147438
N-[2-[(2-chloroacetyl)amino]ethyl]furan-2-carboxamide
CID 108571159
N-[1-(4-phenylphenyl)ethylideneamino]furan-2-carboxamide
CID 761397
N-[2-[(2-benzylbenzoyl)amino]ethyl]furan-2-carboxamide
CID 38227641

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide (CID 30797782) is N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide is O=C(NCCNC(=O)c1ccco1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide?
The InChIKey is QBGONVWBCFBRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c23-19(21-12-13-22-20(24)18-7-4-14-25-18)17-10-8-16(9-11-17)15-5-2-1-3-6-15/h1-11,14H,12-13H2,(H,21,23)(H,22,24).
What are the key properties of N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide?
N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.11, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-phenylbenzoyl)amino]ethyl]furan-2-carboxamide is sourced from PubChem (CID 30797782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).