N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide

C25H18N2O3 — CID 4519967

IUPACN-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C2c3ccccc3-c3ccccc32)cc1)c1ccco1
InChIInChI=1S/C25H18N2O3/c28-24(22-10-5-15-30-22)26-16-11-13-17(14-12-16)27-25(29)23-20-8-3-1-6-18(20)19-7-2-4-9-21(19)23/h1-15,23H,(H,26,28)(H,27,29)
InChIKeyQDLIDSZNLCQZEE-UHFFFAOYSA-N
MW394.43 g/mol
LogP5.28
Rot. Bonds4

About N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide

N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide (PubChem CID 4519967) has the molecular formula C25H18N2O3 and a molecular weight of 394.43 g/mol. Its IUPAC name is N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide
PubChem CID4519967
Molecular FormulaC25H18N2O3
Molecular Weight394.43 g/mol
Exact Mass394.13
IUPAC NameN-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C2c3ccccc3-c3ccccc32)cc1)c1ccco1
InChIInChI=1S/C25H18N2O3/c28-24(22-10-5-15-30-22)26-16-11-13-17(14-12-16)27-25(29)23-20-8-3-1-6-18(20)19-7-2-4-9-21(19)23/h1-15,23H,(H,26,28)(H,27,29)
InChIKeyQDLIDSZNLCQZEE-UHFFFAOYSA-N
XLogP5.28
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.43
LogP ≤ 55.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[4-(methylamino)phenyl]furan-2-carboxamide
CID 63091259
[4-(furan-2-carbonylamino)phenyl]carbamic acid
CID 18543126
N-[4-(cyclohexanecarbonylamino)phenyl]furan-2-carboxamide
CID 3149814
N-[4-(bromomethyl)phenyl]furan-2-carboxamide
CID 114310940
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-[4-(1,3-dioxoisoindol-2-yl)phenyl]furan-2-carboxamide
CID 923784
N-[4-[(2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 872367
N-[4-[(2,2-diphenylacetyl)amino]phenyl]furan-2-carboxamide
CID 2286846
(3R)-N-[4-(furan-2-carbonylamino)phenyl]-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-3-carboxamide
CID 42584682
N-[4-[(4-chlorobenzoyl)amino]phenyl]furan-2-carboxamide
CID 823701
N-[4-[[[2-(2-fluorophenyl)cyclopropanecarbonyl]amino]methyl]phenyl]furan-2-carboxamide
CID 134000496

Frequently Asked Questions

What is the IUPAC name of N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide (CID 4519967) is N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide is O=C(Nc1ccc(NC(=O)C2c3ccccc3-c3ccccc32)cc1)c1ccco1.
What is the InChIKey of N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide?
The InChIKey is QDLIDSZNLCQZEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2O3/c28-24(22-10-5-15-30-22)26-16-11-13-17(14-12-16)27-25(29)23-20-8-3-1-6-18(20)19-7-2-4-9-21(19)23/h1-15,23H,(H,26,28)(H,27,29).
What are the key properties of N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide?
N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide has a molecular weight of 394.43 g/mol, XLogP of 5.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9H-fluorene-9-carbonylamino)phenyl]furan-2-carboxamide is sourced from PubChem (CID 4519967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).