N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide

C24H23FN2O3 — CID 55843746

IUPACN-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESO=C(NCC1(c2ccc(F)cc2)CCCC1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C24H23FN2O3/c25-19-9-7-18(8-10-19)24(13-1-2-14-24)16-26-22(28)17-5-11-20(12-6-17)27-23(29)21-4-3-15-30-21/h3-12,15H,1-2,13-14,16H2,(H,26,28)(H,27,29)
InChIKeyIGWRYTJTPUMHEU-UHFFFAOYSA-N
MW406.46 g/mol
LogP4.91
Rot. Bonds6

About N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide

N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide (PubChem CID 55843746) has the molecular formula C24H23FN2O3 and a molecular weight of 406.46 g/mol. Its IUPAC name is N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide
PubChem CID55843746
Molecular FormulaC24H23FN2O3
Molecular Weight406.46 g/mol
Exact Mass406.17
IUPAC NameN-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESO=C(NCC1(c2ccc(F)cc2)CCCC1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C24H23FN2O3/c25-19-9-7-18(8-10-19)24(13-1-2-14-24)16-26-22(28)17-5-11-20(12-6-17)27-23(29)21-4-3-15-30-21/h3-12,15H,1-2,13-14,16H2,(H,26,28)(H,27,29)
InChIKeyIGWRYTJTPUMHEU-UHFFFAOYSA-N
XLogP4.91
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.46
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(carbamoylamino)-N-[[1-(4-fluorophenyl)cyclohexyl]methyl]benzamide
CID 60571999
N-[4-[(1-hydroxycyclobutyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 111445635
4-fluoro-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 737856
N-(4-fluorophenyl)furan-2-carboxamide
CID 531893
N-[2-methyl-5-[(1-phenylcyclopentyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24571372
4-[(carbamoylamino)methyl]-N-[[1-(4-fluorophenyl)cyclopentyl]methyl]benzamide
CID 47042246
N-[4-[(1-morpholin-4-ylcyclohexyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 9405434
N-[4-[[4-[(4-fluorophenyl)sulfamoyl]benzoyl]amino]phenyl]furan-2-carboxamide
CID 42014548
N-[[4-(4-fluorophenyl)oxan-4-yl]methyl]benzamide
CID 27450186
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-(trifluoromethyl)benzamide
CID 42266020
N-[4-(furan-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 976453
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232

Frequently Asked Questions

What is the IUPAC name of N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide (CID 55843746) is N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide is O=C(NCC1(c2ccc(F)cc2)CCCC1)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is IGWRYTJTPUMHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN2O3/c25-19-9-7-18(8-10-19)24(13-1-2-14-24)16-26-22(28)17-5-11-20(12-6-17)27-23(29)21-4-3-15-30-21/h3-12,15H,1-2,13-14,16H2,(H,26,28)(H,27,29).
What are the key properties of N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide?
N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 406.46 g/mol, XLogP of 4.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[1-(4-fluorophenyl)cyclopentyl]methylcarbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 55843746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).