2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide

C10H13BrN2O2 — CID 104653342

IUPAC2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide
SMILESCC(NC1CC1)(C(N)=O)c1ccc(Br)o1
InChIInChI=1S/C10H13BrN2O2/c1-10(9(12)14,13-6-2-3-6)7-4-5-8(11)15-7/h4-6,13H,2-3H2,1H3,(H2,12,14)
InChIKeyWOKFZPXTHRIMOS-UHFFFAOYSA-N
MW273.13 g/mol
LogP1.49
Rot. Bonds4

About 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide

2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide (PubChem CID 104653342) has the molecular formula C10H13BrN2O2 and a molecular weight of 273.13 g/mol. Its IUPAC name is 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide.

Molecular Properties

Compound Name2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide
PubChem CID104653342
Molecular FormulaC10H13BrN2O2
Molecular Weight273.13 g/mol
Exact Mass272.02
IUPAC Name2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide
SMILESCC(NC1CC1)(C(N)=O)c1ccc(Br)o1
InChIInChI=1S/C10H13BrN2O2/c1-10(9(12)14,13-6-2-3-6)7-4-5-8(11)15-7/h4-6,13H,2-3H2,1H3,(H2,12,14)
InChIKeyWOKFZPXTHRIMOS-UHFFFAOYSA-N
XLogP1.49
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.13
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-bromofuran-2-yl)-2-(cyclopropylmethylamino)propanamide
CID 104653364
ethyl 2-(5-bromofuran-2-yl)-2-(cyclopentylamino)propanoate
CID 113437629
2-(4-tert-butylphenyl)-2-(cyclopropylamino)propanamide
CID 60795288
2-(5-bromofuran-2-yl)-2-(2,2,2-trifluoroethylamino)propanamide
CID 104653438
2-(5-bromofuran-2-yl)-2-[2-(dimethylamino)ethylamino]propanamide
CID 104653361
2-(cyclopropylamino)-2-pyridin-4-ylpropanamide
CID 60795921
2-(3-bromophenyl)-2-(cyclopentylamino)propanamide
CID 54893904
2-(cyclopropylamino)-2-(2,4-difluorophenyl)propanamide
CID 60795802
2-(cyclopentylamino)-2-(4-hydroxyphenyl)propanamide
CID 54894194
2-(cycloheptylamino)-2-phenylpropanamide
CID 54892648
2-(cyclohexylamino)-2-(3,5-dihydroxyphenyl)propanamide
CID 107707551
5-bromo-N-[4-(2-methylbutan-2-yl)cyclohexyl]furan-2-carboxamide
CID 18272889

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide?
The IUPAC name of 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide (CID 104653342) is 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide.
What is the SMILES notation for 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide?
The canonical SMILES for 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide is CC(NC1CC1)(C(N)=O)c1ccc(Br)o1.
What is the InChIKey of 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide?
The InChIKey is WOKFZPXTHRIMOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O2/c1-10(9(12)14,13-6-2-3-6)7-4-5-8(11)15-7/h4-6,13H,2-3H2,1H3,(H2,12,14).
What are the key properties of 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide?
2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide has a molecular weight of 273.13 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromofuran-2-yl)-2-(cyclopropylamino)propanamide is sourced from PubChem (CID 104653342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).