2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide

C12H16ClNO2 — CID 106685258

IUPAC2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide
SMILESCC1CCC(NC(=O)c2ccoc2Cl)CC1
InChIInChI=1S/C12H16ClNO2/c1-8-2-4-9(5-3-8)14-12(15)10-6-7-16-11(10)13/h6-9H,2-5H2,1H3,(H,14,15)
InChIKeyJHTXLSPBTVCOMV-UHFFFAOYSA-N
MW241.72 g/mol
LogP3.24
Rot. Bonds2

About 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide

2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide (PubChem CID 106685258) has the molecular formula C12H16ClNO2 and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide
PubChem CID106685258
Molecular FormulaC12H16ClNO2
Molecular Weight241.72 g/mol
Exact Mass241.09
IUPAC Name2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide
SMILESCC1CCC(NC(=O)c2ccoc2Cl)CC1
InChIInChI=1S/C12H16ClNO2/c1-8-2-4-9(5-3-8)14-12(15)10-6-7-16-11(10)13/h6-9H,2-5H2,1H3,(H,14,15)
InChIKeyJHTXLSPBTVCOMV-UHFFFAOYSA-N
XLogP3.24
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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

2-chloro-N-(2,4-dimethylcyclohexyl)furan-3-carboxamide
CID 106686861
ethyl 4-[(2-chlorofuran-3-carbonyl)amino]cyclohexane-1-carboxylate
CID 106685563
2-chloro-N-[1-(cyclopropylamino)-1-oxopropan-2-yl]furan-3-carboxamide
CID 106687186
N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide
CID 106688544
2-chloro-N-(2-methylcyclohexyl)furan-3-carboxamide
CID 106685279
2-chloro-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]furan-3-carboxamide
CID 106686097
2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide
CID 106687114
2-chloro-N-(3-ethylsulfanylcyclopentyl)furan-3-carboxamide
CID 106812168
2-chloro-N-(oxan-3-yl)furan-3-carboxamide
CID 130173637
5-amino-2-chloro-N-(4-methylcyclohexyl)benzamide
CID 16796108
2-chloro-N-(4-methylcyclohexyl)pyridine-3-carboxamide
CID 21487786
2-chloro-N-(2-hydroxycycloheptyl)furan-3-carboxamide
CID 106687172

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide (CID 106685258) is 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide is CC1CCC(NC(=O)c2ccoc2Cl)CC1.
What is the InChIKey of 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide?
The InChIKey is JHTXLSPBTVCOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO2/c1-8-2-4-9(5-3-8)14-12(15)10-6-7-16-11(10)13/h6-9H,2-5H2,1H3,(H,14,15).
What are the key properties of 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide?
2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide has a molecular weight of 241.72 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide is sourced from PubChem (CID 106685258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).