N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide

C16H26N2O2 — CID 81485921

IUPACN-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide
SMILESCc1oc(C)c(C(=O)NC(CN)C2CCCCC2)c1C
InChIInChI=1S/C16H26N2O2/c1-10-11(2)20-12(3)15(10)16(19)18-14(9-17)13-7-5-4-6-8-13/h13-14H,4-9,17H2,1-3H3,(H,18,19)
InChIKeyCPUNAQONZNRLDL-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.84
Rot. Bonds4

About N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide

N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide (PubChem CID 81485921) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide
PubChem CID81485921
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide
SMILESCc1oc(C)c(C(=O)NC(CN)C2CCCCC2)c1C
InChIInChI=1S/C16H26N2O2/c1-10-11(2)20-12(3)15(10)16(19)18-14(9-17)13-7-5-4-6-8-13/h13-14H,4-9,17H2,1-3H3,(H,18,19)
InChIKeyCPUNAQONZNRLDL-UHFFFAOYSA-N
XLogP2.84
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-cyclopentylethyl)-2,5-dimethylfuran-3-carboxamide
CID 106737497
N-(2-amino-1-cyclohexylethyl)-5-ethyl-4-methylfuran-2-carboxamide;hydrochloride
CID 119590238
N-(2-amino-1-cyclohexylethyl)-2,4,6-trifluorobenzamide
CID 81487271
N-(2-amino-1-cyclohexylethyl)-4-(dimethylsulfamoyl)-5-methylfuran-2-carboxamide;hydrochloride
CID 119592207
N-(2-amino-1-cyclohexylethyl)-3-methyl-1-benzofuran-2-carboxamide;hydrochloride
CID 119592038
N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide
CID 106737570
N-(2-amino-1-cyclohexylethyl)-5-methylfuro[3,2-b]pyridine-2-carboxamide
CID 119592125
N-(2-amino-1-cyclohexylethyl)-2-methylbenzamide;hydrochloride
CID 119588952
N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide
CID 119589648
N-(2-amino-1-cyclohexylethyl)-3,5-dimethoxy-4-methylbenzamide;hydrochloride
CID 119592013
ethyl N-(2-amino-1-cyclooctylethyl)carbamate
CID 114207874
N-(2-amino-1-cyclohexylethyl)-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 119590660

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide (CID 81485921) is N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide is Cc1oc(C)c(C(=O)NC(CN)C2CCCCC2)c1C.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide?
The InChIKey is CPUNAQONZNRLDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-10-11(2)20-12(3)15(10)16(19)18-14(9-17)13-7-5-4-6-8-13/h13-14H,4-9,17H2,1-3H3,(H,18,19).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide?
N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide is sourced from PubChem (CID 81485921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).