N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide

C19H25NO4S — CID 18999495

IUPACN-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide
SMILESO=S(=O)(NCC1(Cc2ccc(CCO)cc2)CCCC1)c1ccco1
InChIInChI=1S/C19H25NO4S/c21-12-9-16-5-7-17(8-6-16)14-19(10-1-2-11-19)15-20-25(22,23)18-4-3-13-24-18/h3-8,13,20-21H,1-2,9-12,14-15H2
InChIKeyNPUYMSACWLOQMD-UHFFFAOYSA-N
MW363.48 g/mol
LogP2.90
Rot. Bonds8

About N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide

N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide (PubChem CID 18999495) has the molecular formula C19H25NO4S and a molecular weight of 363.48 g/mol. Its IUPAC name is N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide.

Molecular Properties

Compound NameN-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide
PubChem CID18999495
Molecular FormulaC19H25NO4S
Molecular Weight363.48 g/mol
Exact Mass363.15
IUPAC NameN-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide
SMILESO=S(=O)(NCC1(Cc2ccc(CCO)cc2)CCCC1)c1ccco1
InChIInChI=1S/C19H25NO4S/c21-12-9-16-5-7-17(8-6-16)14-19(10-1-2-11-19)15-20-25(22,23)18-4-3-13-24-18/h3-8,13,20-21H,1-2,9-12,14-15H2
InChIKeyNPUYMSACWLOQMD-UHFFFAOYSA-N
XLogP2.90
TPSA79.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.48
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-{2-[4-(furan-2-yl)phenyl]-2-hydroxyethyl}-2-methylbenzene-1-sulfonamide
CID 126852748
2-[4-(furan-2-yl)phenyl]-2-hydroxy-S-[3-(trifluoromethyl)phenyl]ethane-1-sulfonamido
CID 126852755
N-[(2R)-2-[4-(furan-2-yl)phenyl]-2-hydroxyethyl]-3-(trifluoromethyl)benzenesulfonamide
CID 129564720
N-[(2S)-2-[4-(furan-2-yl)phenyl]-2-hydroxyethyl]-3-(trifluoromethyl)benzenesulfonamide
CID 129564721
4-fluoro-N-[(2R)-2-[4-(furan-2-yl)phenyl]-2-hydroxyethyl]-2-methylbenzenesulfonamide
CID 129564834
4-fluoro-N-[(2S)-2-[4-(furan-2-yl)phenyl]-2-hydroxyethyl]-2-methylbenzenesulfonamide
CID 129564838
N-[[4-(4-fluorophenyl)oxan-4-yl]methyl]-5-methylfuran-2-sulfonamide
CID 132304204
[3-[(4-Fluorophenyl)methyl]-1-(furan-3-ylsulfonyl)pyrrolidin-3-yl]methanol
CID 139001899
N-ethyl-3-(3-fluoro-4-formylphenyl)furan-2-sulfonamide
CID 165952343
2-[(4-Fluorophenyl)methyl]-3-[(4-methylfuran-2-yl)sulfonylamino]propanoic acid
CID 166293275
2-[4-[[1-[(Furan-2-ylsulfonylamino)methyl]cyclopentyl]methyl]phenyl]acetic acid
CID 18999610
N-[(E)-5-(furan-2-yl)-1-hydroxypent-4-en-2-yl]-4-methylbenzenesulfonamide
CID 11726999

Frequently Asked Questions

What is the IUPAC name of N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide?
The IUPAC name of N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide (CID 18999495) is N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide.
What is the SMILES notation for N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide?
The canonical SMILES for N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide is O=S(=O)(NCC1(Cc2ccc(CCO)cc2)CCCC1)c1ccco1.
What is the InChIKey of N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide?
The InChIKey is NPUYMSACWLOQMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO4S/c21-12-9-16-5-7-17(8-6-16)14-19(10-1-2-11-19)15-20-25(22,23)18-4-3-13-24-18/h3-8,13,20-21H,1-2,9-12,14-15H2.
What are the key properties of N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide?
N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide has a molecular weight of 363.48 g/mol, XLogP of 2.90, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[[4-(2-hydroxyethyl)phenyl]methyl]cyclopentyl]methyl]furan-2-sulfonamide is sourced from PubChem (CID 18999495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).