N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide

C19H22N2O4 — CID 109400174

IUPACN-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCN(CC1CCCC1O)C(=O)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C19H22N2O4/c1-21(12-14-4-2-5-16(14)22)19(24)13-7-9-15(10-8-13)20-18(23)17-6-3-11-25-17/h3,6-11,14,16,22H,2,4-5,12H2,1H3,(H,20,23)
InChIKeyQAICAJZMMDCXNL-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.76
Rot. Bonds5

About N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide

N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide (PubChem CID 109400174) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide
PubChem CID109400174
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCN(CC1CCCC1O)C(=O)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C19H22N2O4/c1-21(12-14-4-2-5-16(14)22)19(24)13-7-9-15(10-8-13)20-18(23)17-6-3-11-25-17/h3,6-11,14,16,22H,2,4-5,12H2,1H3,(H,20,23)
InChIKeyQAICAJZMMDCXNL-UHFFFAOYSA-N
XLogP2.76
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(4-chlorophenyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide
CID 17403165
N-[4-[methyl-[(2-methylphenyl)methyl]carbamoyl]phenyl]furan-2-carboxamide
CID 9379021
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-[4-[benzyl(ethyl)carbamoyl]phenyl]furan-2-carboxamide
CID 17399777
N-[4-[(2-chloro-6-fluorophenyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide
CID 18112182
N-[4-[(4-acetamidophenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24628897
N-[4-[(1-hydroxycyclobutyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 111445635
N-[4-[ethyl(phenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 2979994
N-[4-[methyl-[1-(4-methylphenyl)ethyl]carbamoyl]phenyl]furan-2-carboxamide
CID 134054275
N-[4-(methylamino)phenyl]furan-2-carboxamide
CID 63091259
N-[(2S)-1-[[(1S,2S)-2-hydroxycyclopentyl]methylamino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide
CID 95781275
N-[4-[[4-(2-hydroxycyclohexyl)oxyphenyl]carbamoyl]phenyl]furan-2-carboxamide
CID 86974264

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide (CID 109400174) is N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide is CN(CC1CCCC1O)C(=O)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is QAICAJZMMDCXNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-21(12-14-4-2-5-16(14)22)19(24)13-7-9-15(10-8-13)20-18(23)17-6-3-11-25-17/h3,6-11,14,16,22H,2,4-5,12H2,1H3,(H,20,23).
What are the key properties of N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide?
N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 109400174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).