N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide

C11H16N2O4 — CID 43390516

IUPACN-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide
SMILESCC(C)(CO)NC(=O)CNC(=O)c1ccco1
InChIInChI=1S/C11H16N2O4/c1-11(2,7-14)13-9(15)6-12-10(16)8-4-3-5-17-8/h3-5,14H,6-7H2,1-2H3,(H,12,16)(H,13,15)
InChIKeyAUCAOGYYCHDVLA-UHFFFAOYSA-N
MW240.26 g/mol
LogP-0.10
Rot. Bonds5

About N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide

N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide (PubChem CID 43390516) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide
PubChem CID43390516
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC NameN-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide
SMILESCC(C)(CO)NC(=O)CNC(=O)c1ccco1
InChIInChI=1S/C11H16N2O4/c1-11(2,7-14)13-9(15)6-12-10(16)8-4-3-5-17-8/h3-5,14H,6-7H2,1-2H3,(H,12,16)(H,13,15)
InChIKeyAUCAOGYYCHDVLA-UHFFFAOYSA-N
XLogP-0.10
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-0.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[[1-hydroxy-2-(hydroxymethyl)butan-2-yl]amino]-2-oxoethyl]furan-2-carboxamide
CID 103602259
N-[2-[(1-hydroxy-3-methylpentan-3-yl)amino]-2-oxoethyl]furan-2-carboxamide
CID 104709146
methyl 2-[[2-(furan-2-carbonylamino)acetyl]amino]-2-methylpentanoate
CID 43623892
tert-butyl 2-(furan-2-carbonylamino)acetate
CID 78966369
N-[2-[(2-hydroxy-2-methyl-3-methylsulfanylpropyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 103711886
4-[[2-(furan-2-carbonylamino)acetyl]amino]-3-hydroxy-3-methylbutanoic acid
CID 66003494
N-[3-[(1-hydroxy-2-methylbutan-2-yl)amino]-3-oxopropyl]furan-2-carboxamide
CID 64555440
tert-butyl N-[2-[2-(furan-2-carbonylamino)ethylamino]-2-oxoethyl]carbamate
CID 108537102
N-[2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 7535615
N-[2-[2-(4-tert-butyl-2,6-dimethylphenyl)ethylamino]-2-oxoethyl]furan-2-carboxamide
CID 9162978
N-[2-(2,6-difluoroanilino)-2-oxoethyl]furan-2-carboxamide
CID 110698062
N-[2-oxo-2-(phenylmethoxyamino)ethyl]furan-2-carboxamide
CID 9227365

Frequently Asked Questions

What is the IUPAC name of N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide (CID 43390516) is N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide is CC(C)(CO)NC(=O)CNC(=O)c1ccco1.
What is the InChIKey of N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide?
The InChIKey is AUCAOGYYCHDVLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c1-11(2,7-14)13-9(15)6-12-10(16)8-4-3-5-17-8/h3-5,14H,6-7H2,1-2H3,(H,12,16)(H,13,15).
What are the key properties of N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide?
N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide has a molecular weight of 240.26 g/mol, XLogP of -0.10, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 43390516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).