5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide

C17H18ClNO3 — CID 24979506

IUPAC5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H18ClNO3/c18-12-3-1-11(2-4-12)15-9-10-16(22-15)17(21)19-13-5-7-14(20)8-6-13/h1-4,9-10,13-14,20H,5-8H2,(H,19,21)
InChIKeyWDSYWQOXHOWHET-UHFFFAOYSA-N
MW319.79 g/mol
LogP3.63
Rot. Bonds3

About 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide

5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide (PubChem CID 24979506) has the molecular formula C17H18ClNO3 and a molecular weight of 319.79 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide
PubChem CID24979506
Molecular FormulaC17H18ClNO3
Molecular Weight319.79 g/mol
Exact Mass319.10
IUPAC Name5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C17H18ClNO3/c18-12-3-1-11(2-4-12)15-9-10-16(22-15)17(21)19-13-5-7-14(20)8-6-13/h1-4,9-10,13-14,20H,5-8H2,(H,19,21)
InChIKeyWDSYWQOXHOWHET-UHFFFAOYSA-N
XLogP3.63
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(4-Chlorophenyl)-2-furoyl]piperazine
CID 24857857
5-(4-chlorophenyl)-N-[(1S)-1-cyclohexyl-2-(methylamino)-2-oxoethyl]furan-2-carboxamide
CID 44182306
2N-methyl-4N-(4-oxidanylcyclohexyl)-5-[(1S)-1-phenylethyl]furan-2,4-dicarboxamide
CID 146434124
7-(2-chloro-5-cyanophenyl)-N-[(1S,3R)-3-hydroxycyclopentyl]-1-benzofuran-2-carboxamide
CID 168284425
[5-(2,4-Dichlorophenyl)furan-2-yl](morpholin-4-yl)methanone
CID 919410
5-(3-chlorophenyl)-N-(furan-2-ylmethyl)furan-2-carboxamide
CID 944598
N-(sec-butyl)-5-{[(4-chlorobenzyl)thio]methyl}-2-furamide
CID 3616502
[5-(2-Chlorophenyl)furan-2-yl]-(4-methylpiperidin-1-yl)methanone
CID 4494608
1-(Furan-2-carbonyl)-piperidine-4-carboxylic acid 4-chloro-benzylamide
CID 6463437
N-cyclohexyl-5-(2-fluorophenyl)furan-2-carboxamide
CID 7594453
[5-(2-Chlorophenyl)-2-furyl]-(3-methylpiperidino)methanone
CID 18105311
5-(4-chlorophenyl)-N-cyclohexyl-2-furamide
CID 18230215

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide (CID 24979506) is 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide is O=C(NC1CCC(O)CC1)c1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
The InChIKey is WDSYWQOXHOWHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO3/c18-12-3-1-11(2-4-12)15-9-10-16(22-15)17(21)19-13-5-7-14(20)8-6-13/h1-4,9-10,13-14,20H,5-8H2,(H,19,21).
What are the key properties of 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide?
5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide has a molecular weight of 319.79 g/mol, XLogP of 3.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-(4-hydroxycyclohexyl)furan-2-carboxamide is sourced from PubChem (CID 24979506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).