N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide

C12H17BrN2O2 — CID 106737570

IUPACN-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide
SMILESNCC(NC(=O)c1ccc(Br)o1)C1CCCC1
InChIInChI=1S/C12H17BrN2O2/c13-11-6-5-10(17-11)12(16)15-9(7-14)8-3-1-2-4-8/h5-6,8-9H,1-4,7,14H2,(H,15,16)
InChIKeyMXFBOAHXUTYYNL-UHFFFAOYSA-N
MW301.18 g/mol
LogP2.29
Rot. Bonds4

About N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide

N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide (PubChem CID 106737570) has the molecular formula C12H17BrN2O2 and a molecular weight of 301.18 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide
PubChem CID106737570
Molecular FormulaC12H17BrN2O2
Molecular Weight301.18 g/mol
Exact Mass300.05
IUPAC NameN-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide
SMILESNCC(NC(=O)c1ccc(Br)o1)C1CCCC1
InChIInChI=1S/C12H17BrN2O2/c13-11-6-5-10(17-11)12(16)15-9(7-14)8-3-1-2-4-8/h5-6,8-9H,1-4,7,14H2,(H,15,16)
InChIKeyMXFBOAHXUTYYNL-UHFFFAOYSA-N
XLogP2.29
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.18
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(1-cyclohexylethyl)furan-2-carboxamide
CID 55069127
N-(2-amino-1-cyclohexylethyl)-5-(methylsulfonylmethyl)furan-2-carboxamide
CID 119589648
5-bromo-N-(1-cyclopropylethyl)furan-2-carboxamide
CID 60668708
N-(2-amino-1-cyclohexylethyl)-3,5-dibromobenzamide
CID 107973523
5-bromo-N-cyclododecylfuran-2-carboxamide
CID 2072742
N-(2-amino-1-cyclopentylethyl)-4-bromo-2-hydroxybenzamide
CID 106737241
N-[(1R,2R)-2-aminocyclohexyl]-5-bromofuran-2-carboxamide
CID 93452199
N-(2-amino-1-cyclopentylethyl)-5-ethylthiophene-2-carboxamide
CID 106737412
N-(2-amino-1-cyclohexylethyl)-2,4,5-trimethylfuran-3-carboxamide
CID 81485921
N-(2-amino-1-cyclopentylethyl)-4-bromo-2,6-difluorobenzamide
CID 106737293
N-(2-amino-1-cyclopentylethyl)-1H-pyrazole-5-carboxamide
CID 106737632
N-(2-amino-1-cyclohexylethyl)-5-methylfuro[3,2-b]pyridine-2-carboxamide
CID 119592125

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide (CID 106737570) is N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide is NCC(NC(=O)c1ccc(Br)o1)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide?
The InChIKey is MXFBOAHXUTYYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17BrN2O2/c13-11-6-5-10(17-11)12(16)15-9(7-14)8-3-1-2-4-8/h5-6,8-9H,1-4,7,14H2,(H,15,16).
What are the key properties of N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide?
N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide has a molecular weight of 301.18 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-5-bromofuran-2-carboxamide is sourced from PubChem (CID 106737570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).