N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide

C11H15NO2 — CID 90536003

IUPACN-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide
SMILESCc1cc(CNC(=O)C2CC2)c(C)o1
InChIInChI=1S/C11H15NO2/c1-7-5-10(8(2)14-7)6-12-11(13)9-3-4-9/h5,9H,3-4,6H2,1-2H3,(H,12,13)
InChIKeyMPOYGGKPVYDPMC-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.92
Rot. Bonds3

About N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide

N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide (PubChem CID 90536003) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide
PubChem CID90536003
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC NameN-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide
SMILESCc1cc(CNC(=O)C2CC2)c(C)o1
InChIInChI=1S/C11H15NO2/c1-7-5-10(8(2)14-7)6-12-11(13)9-3-4-9/h5,9H,3-4,6H2,1-2H3,(H,12,13)
InChIKeyMPOYGGKPVYDPMC-UHFFFAOYSA-N
XLogP1.92
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-cyanophenyl)sulfonyl-N-[(2,5-dimethylfuran-3-yl)methyl]piperidine-4-carboxamide
CID 86950358
N'-[(2,5-dimethylfuran-3-yl)methyl]-N-propyloxamide
CID 90536222
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]cyclopropanecarboxamide
CID 103623190
1-(3-cyclopentylpropyl)-3-[(2,5-dimethylfuran-3-yl)methyl]urea
CID 86952275
N-[(2,5-dimethylfuran-3-yl)methyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111438818
2-cyclopentyl-N-[(2,5-dimethylfuran-3-yl)methyl]pyrrolidine-1-carboxamide
CID 86952444
N-[(3-methyl-1,2-oxazol-4-yl)methyl]cyclopropanecarboxamide
CID 130987515
N-[(5-bromo-2-methylphenyl)methyl]cyclopropanecarboxamide
CID 95971045
N-[2-(2,5-dimethylfuran-3-yl)-2-hydroxypropyl]-4-methylcyclohexane-1-carboxamide
CID 111479183
5-chloro-N-[(2,5-dimethylfuran-3-yl)methyl]thiophene-2-carboxamide
CID 90536055
1-benzyl-N-[(2,5-dimethylfuran-3-yl)methyl]-6-oxo-2-phenylpiperidine-3-carboxamide
CID 86950512
1-(2,5-dimethylfuran-3-yl)-N-methylmethanamine
CID 43163687

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide (CID 90536003) is N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide is Cc1cc(CNC(=O)C2CC2)c(C)o1.
What is the InChIKey of N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide?
The InChIKey is MPOYGGKPVYDPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-7-5-10(8(2)14-7)6-12-11(13)9-3-4-9/h5,9H,3-4,6H2,1-2H3,(H,12,13).
What are the key properties of N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide?
N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide has a molecular weight of 193.25 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethylfuran-3-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 90536003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).