N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide

C11H18N2O2 — CID 106139606

IUPACN-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide
SMILESCC(C)(CCN)CNC(=O)c1ccoc1
InChIInChI=1S/C11H18N2O2/c1-11(2,4-5-12)8-13-10(14)9-3-6-15-7-9/h3,6-7H,4-5,8,12H2,1-2H3,(H,13,14)
InChIKeySQTWMTZJFMZSKE-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.38
Rot. Bonds5

About N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide

N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide (PubChem CID 106139606) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide
PubChem CID106139606
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide
SMILESCC(C)(CCN)CNC(=O)c1ccoc1
InChIInChI=1S/C11H18N2O2/c1-11(2,4-5-12)8-13-10(14)9-3-6-15-7-9/h3,6-7H,4-5,8,12H2,1-2H3,(H,13,14)
InChIKeySQTWMTZJFMZSKE-UHFFFAOYSA-N
XLogP1.38
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,4-dimethylpentyl)furan-3-carboxamide
CID 20774387
N-(4-amino-2,2-dimethylbutyl)-4-ethylbenzamide
CID 114148877
N-(4-amino-2,2-dimethylbutyl)-3,5-dihydroxybenzamide
CID 114148875
N-(4-amino-2,2-dimethylbutyl)furan-2-carboxamide
CID 106139844
N-(4-amino-2,2-dimethylbutyl)-3,4,5-trifluorobenzamide
CID 106139619
N-(4-amino-2,2-dimethylbutyl)-2-oxo-1H-pyridine-4-carboxamide
CID 106140156
N-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropyl]furan-3-carboxamide
CID 29302140
N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylpropyl]furan-3-carboxamide
CID 29302135
N-(4-hydroxy-2-methylbutan-2-yl)furan-3-carboxamide
CID 115869863
N-[(2S,3S)-2-benzyl-3-hydroxy-2-methylbutyl]furan-3-carboxamide
CID 99795548
N-(2-benzyl-3-hydroxy-2-methylbutyl)furan-3-carboxamide
CID 102562916
N-[1-[(2-amino-2-methylpropyl)amino]-1-oxopropan-2-yl]furan-3-carboxamide
CID 119626005

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide?
The IUPAC name of N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide (CID 106139606) is N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide.
What is the SMILES notation for N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide?
The canonical SMILES for N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide is CC(C)(CCN)CNC(=O)c1ccoc1.
What is the InChIKey of N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide?
The InChIKey is SQTWMTZJFMZSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-11(2,4-5-12)8-13-10(14)9-3-6-15-7-9/h3,6-7H,4-5,8,12H2,1-2H3,(H,13,14).
What are the key properties of N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide?
N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 1.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2,2-dimethylbutyl)furan-3-carboxamide is sourced from PubChem (CID 106139606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).