5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide

C18H20ClNO2 — CID 16651413

IUPAC5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(Cl)cc2)cc1C(=O)NC1CCCCC1
InChIInChI=1S/C18H20ClNO2/c1-12-16(18(21)20-15-5-3-2-4-6-15)11-17(22-12)13-7-9-14(19)10-8-13/h7-11,15H,2-6H2,1H3,(H,20,21)
InChIKeyLHQWQZOGPZHFLT-UHFFFAOYSA-N
MW317.82 g/mol
LogP4.97
Rot. Bonds3

About 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide

5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide (PubChem CID 16651413) has the molecular formula C18H20ClNO2 and a molecular weight of 317.82 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide
PubChem CID16651413
Molecular FormulaC18H20ClNO2
Molecular Weight317.82 g/mol
Exact Mass317.12
IUPAC Name5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(Cl)cc2)cc1C(=O)NC1CCCCC1
InChIInChI=1S/C18H20ClNO2/c1-12-16(18(21)20-15-5-3-2-4-6-15)11-17(22-12)13-7-9-14(19)10-8-13/h7-11,15H,2-6H2,1H3,(H,20,21)
InChIKeyLHQWQZOGPZHFLT-UHFFFAOYSA-N
XLogP4.97
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.82
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-chlorophenyl)-N-cyclohexyl-2-furamide
CID 18230215
2,5-dimethyl-N-[1-(4-methylphenyl)ethyl]furan-3-carboxamide
CID 2932803
2-methyl-N-(4-phenylbutan-2-yl)furan-3-carboxamide
CID 2933467
N-[(4-chlorophenyl)methyl]-2-phenoxybenzamide
CID 797976
5-[(1S)-1-(4-chlorophenyl)ethyl]-4-N-(4-hydroxycyclohexyl)-2-N-methylfuran-2,4-dicarboxamide
CID 146434192
5-(3,5-dichlorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-furamide
CID 1300140
N-[(Z)-1-[5-(4-chlorophenyl)furan-2-yl]-3-[3-(dimethylamino)propylamino]-3-oxoprop-1-en-2-yl]-4-methylbenzamide
CID 1934103
N-[2-[5-(4-chlorophenyl)-2-furyl]-1-({[2-(dimethylamino)ethyl]amino}carbonyl)vinyl]benzamide
CID 2131824
5-(3,4-dichlorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-furamide
CID 2214201
5-(3,5-dichlorophenyl)-2-methyl-N-(2-phenylethyl)-3-furamide
CID 2214306
N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide
CID 4879946
Ethyl 4-(4-chlorobenzyl)-1-(3-furoyl)-4-piperidinecarboxylate
CID 16191140

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide (CID 16651413) is 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide is Cc1oc(-c2ccc(Cl)cc2)cc1C(=O)NC1CCCCC1.
What is the InChIKey of 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide?
The InChIKey is LHQWQZOGPZHFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO2/c1-12-16(18(21)20-15-5-3-2-4-6-15)11-17(22-12)13-7-9-14(19)10-8-13/h7-11,15H,2-6H2,1H3,(H,20,21).
What are the key properties of 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide?
5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide has a molecular weight of 317.82 g/mol, XLogP of 4.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-cyclohexyl-2-methylfuran-3-carboxamide is sourced from PubChem (CID 16651413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).