5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide

C12H16ClNO2 — CID 35895984

IUPAC5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide
SMILESO=C(NCC1CCCCC1)c1ccc(Cl)o1
InChIInChI=1S/C12H16ClNO2/c13-11-7-6-10(16-11)12(15)14-8-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2,(H,14,15)
InChIKeySOJUMYGFCOPATC-UHFFFAOYSA-N
MW241.72 g/mol
LogP3.24
Rot. Bonds3

About 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide

5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide (PubChem CID 35895984) has the molecular formula C12H16ClNO2 and a molecular weight of 241.72 g/mol. Its IUPAC name is 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide
PubChem CID35895984
Molecular FormulaC12H16ClNO2
Molecular Weight241.72 g/mol
Exact Mass241.09
IUPAC Name5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide
SMILESO=C(NCC1CCCCC1)c1ccc(Cl)o1
InChIInChI=1S/C12H16ClNO2/c13-11-7-6-10(16-11)12(15)14-8-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2,(H,14,15)
InChIKeySOJUMYGFCOPATC-UHFFFAOYSA-N
XLogP3.24
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[(4-chlorocyclohexyl)methyl]furan-2-carboxamide
CID 106133378
5-chloro-N-[(3-methylcyclopentyl)methyl]furan-2-carboxamide
CID 107413499
5-chloro-N-[2-(2-methylcyclohexyl)oxyethyl]furan-2-carboxamide
CID 51115806
5-chloro-N-[2-(cyclopropylamino)-2-oxoethyl]furan-2-carboxamide
CID 103606885
5-chloro-N-[2-(4-methylcyclohexyl)ethyl]furan-2-carboxamide
CID 106686875
4-chloro-N-(cyclohexylmethyl)pyridine-3-carboxamide
CID 81225483
N-[3-(4-aminocyclohexyl)oxypropyl]-5-chlorofuran-2-carboxamide
CID 63871144
2-chloro-N-(cyclobutylmethyl)furan-3-carboxamide
CID 106685401
N-(cyclohexylmethyl)-2-(4-fluorophenyl)acetamide
CID 83278373
2,3-dichloro-N-(cyclohexylmethyl)benzamide
CID 23019884
5-bromo-2-chloro-N-(cyclobutylmethyl)benzamide
CID 38655696
5-bromo-N-(2-cyclopentylethyl)furan-2-carboxamide
CID 55028748

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide?
The IUPAC name of 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide (CID 35895984) is 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide?
The canonical SMILES for 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide is O=C(NCC1CCCCC1)c1ccc(Cl)o1.
What is the InChIKey of 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide?
The InChIKey is SOJUMYGFCOPATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO2/c13-11-7-6-10(16-11)12(15)14-8-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2,(H,14,15).
What are the key properties of 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide?
5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide has a molecular weight of 241.72 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(cyclohexylmethyl)furan-2-carboxamide is sourced from PubChem (CID 35895984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).