5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide

C12H18N2O2 — CID 107422841

IUPAC5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)NC2(C)CCNC2)o1
InChIInChI=1S/C12H18N2O2/c1-3-9-4-5-10(16-9)11(15)14-12(2)6-7-13-8-12/h4-5,13H,3,6-8H2,1-2H3,(H,14,15)
InChIKeyVTJPOCJGBMESPE-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.32
Rot. Bonds3

About 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide

5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide (PubChem CID 107422841) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide
PubChem CID107422841
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)NC2(C)CCNC2)o1
InChIInChI=1S/C12H18N2O2/c1-3-9-4-5-10(16-9)11(15)14-12(2)6-7-13-8-12/h4-5,13H,3,6-8H2,1-2H3,(H,14,15)
InChIKeyVTJPOCJGBMESPE-UHFFFAOYSA-N
XLogP1.32
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylpyrrolidin-3-yl)-5-nitrofuran-2-carboxamide
CID 107423013
5-ethyl-N-[1-(hydroxymethyl)cyclopropyl]furan-2-carboxamide
CID 115764668
5-ethyl-N-[(3-methylpiperidin-3-yl)methyl]furan-2-carboxamide
CID 113400454
N-(1-cyanocycloheptyl)-5-ethylfuran-2-carboxamide
CID 112731234
3-ethyl-1-methyl-N-(3-methylpyrrolidin-3-yl)pyrazole-4-carboxamide
CID 107422800
5-ethyl-N-piperidin-4-ylfuran-2-carboxamide
CID 78981214
7-bromo-N-(3-methylpyrrolidin-3-yl)-1-benzofuran-2-carboxamide
CID 107422643
1,4-diazaspiro[5.5]undecan-1-yl-(5-ethylfuran-2-yl)methanone
CID 79094761
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
N-[[1-(aminomethyl)cyclopropyl]methyl]-5-ethylfuran-2-carboxamide
CID 115456771
5-ethyl-N-[(1-hydroxycyclohexyl)methyl]furan-2-carboxamide
CID 64868940
N-(4-carbamothioyl-1-methylpiperidin-4-yl)-5-ethylfuran-2-carboxamide
CID 79095992

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide (CID 107422841) is 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide is CCc1ccc(C(=O)NC2(C)CCNC2)o1.
What is the InChIKey of 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide?
The InChIKey is VTJPOCJGBMESPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-9-4-5-10(16-9)11(15)14-12(2)6-7-13-8-12/h4-5,13H,3,6-8H2,1-2H3,(H,14,15).
What are the key properties of 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide?
5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(3-methylpyrrolidin-3-yl)furan-2-carboxamide is sourced from PubChem (CID 107422841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).