N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide

C11H16N2O3 — CID 62734384

IUPACN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)c1ccco1
InChIInChI=1S/C11H16N2O3/c1-8(2)6-13(7-10(12)14)11(15)9-4-3-5-16-9/h3-5,8H,6-7H2,1-2H3,(H2,12,14)
InChIKeyZJOPAOFJNCKRSD-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.86
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide

N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide (PubChem CID 62734384) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide
PubChem CID62734384
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)c1ccco1
InChIInChI=1S/C11H16N2O3/c1-8(2)6-13(7-10(12)14)11(15)9-4-3-5-16-9/h3-5,8H,6-7H2,1-2H3,(H2,12,14)
InChIKeyZJOPAOFJNCKRSD-UHFFFAOYSA-N
XLogP0.86
TPSA76.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)furan-2-carboxamide
CID 60779427
2-[benzylcarbamoyl(2-methylpropyl)amino]acetamide
CID 107653133
N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 4577131
N-(2-methylpropyl)-N-[(3-phenylmethoxyphenyl)methyl]furan-2-carboxamide
CID 42725509
N-(1,3-benzodioxol-4-ylmethyl)-N-(2-methylpropyl)furan-2-carboxamide
CID 24715098
N-(2-amino-2-hydroxyiminoethyl)-N-methylfuran-2-carboxamide
CID 76928863
N-[2-[[1,4-bis(4-methylphenyl)imidazol-2-yl]amino]-2-oxoethyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 46145519
2-[furan-2-carbonyl(hydroxymethyl)amino]acetic acid
CID 126504893
N-(2-aminoethyl)-N-ethylfuran-2-carboxamide
CID 28707635
N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 55060862
N-(2-aminoethyl)-N-(2,2-difluoroethyl)furan-2-carboxamide
CID 107493246
N,N-dibenzylfuran-2-carboxamide
CID 762503

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide (CID 62734384) is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide is CC(C)CN(CC(N)=O)C(=O)c1ccco1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide?
The InChIKey is ZJOPAOFJNCKRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-8(2)6-13(7-10(12)14)11(15)9-4-3-5-16-9/h3-5,8H,6-7H2,1-2H3,(H2,12,14).
What are the key properties of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide?
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide is sourced from PubChem (CID 62734384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).