N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide

C10H11BrClNO2 — CID 106689937

IUPACN-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide
SMILESO=C(c1ccc(Cl)o1)N(CCBr)C1CC1
InChIInChI=1S/C10H11BrClNO2/c11-5-6-13(7-1-2-7)10(14)8-3-4-9(12)15-8/h3-4,7H,1-2,5-6H2
InChIKeyFUUOEQOLCVWPRZ-UHFFFAOYSA-N
MW292.56 g/mol
LogP2.93
Rot. Bonds4

About N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide

N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide (PubChem CID 106689937) has the molecular formula C10H11BrClNO2 and a molecular weight of 292.56 g/mol. Its IUPAC name is N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide
PubChem CID106689937
Molecular FormulaC10H11BrClNO2
Molecular Weight292.56 g/mol
Exact Mass290.97
IUPAC NameN-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide
SMILESO=C(c1ccc(Cl)o1)N(CCBr)C1CC1
InChIInChI=1S/C10H11BrClNO2/c11-5-6-13(7-1-2-7)10(14)8-3-4-9(12)15-8/h3-4,7H,1-2,5-6H2
InChIKeyFUUOEQOLCVWPRZ-UHFFFAOYSA-N
XLogP2.93
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.56
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide
CID 66183740
N-(4-aminocyclohexyl)-5-chloro-N-ethylfuran-2-carboxamide
CID 79116022
N-(2-amino-2-oxoethyl)-5-chloro-N-piperidin-4-ylfuran-2-carboxamide
CID 54923700
N-(2-bromoethyl)-5-chloro-N-(2-methoxyethyl)furan-2-carboxamide
CID 106690138
N-(2-bromoethyl)-N-cyclopropylfuran-3-carboxamide
CID 80665124
N-(2-bromoethyl)-2-chloro-N-cyclopentylfuran-3-carboxamide
CID 106689910
2-[(5-chlorofuran-2-carbonyl)-(1-methylsulfonylpiperidin-4-yl)amino]acetic acid
CID 128968650
N-(2-bromoethyl)-2-chloro-N-cyclohexylfuran-3-carboxamide
CID 106689912
5-bromo-N-cyclopropyl-N-(3-methylbutyl)furan-2-carboxamide
CID 60733156
N-(2-bromoethyl)-2,6-dichloro-N-cyclopentylbenzamide
CID 80658796
N-(azetidin-3-yl)-5-chloro-N-methylfuran-2-carboxamide
CID 66185904
5-bromo-N-cyclopropyl-N-ethylfuran-2-carboxamide
CID 60729086

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide?
The IUPAC name of N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide (CID 106689937) is N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide.
What is the SMILES notation for N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide?
The canonical SMILES for N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide is O=C(c1ccc(Cl)o1)N(CCBr)C1CC1.
What is the InChIKey of N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide?
The InChIKey is FUUOEQOLCVWPRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrClNO2/c11-5-6-13(7-1-2-7)10(14)8-3-4-9(12)15-8/h3-4,7H,1-2,5-6H2.
What are the key properties of N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide?
N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide has a molecular weight of 292.56 g/mol, XLogP of 2.93, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide is sourced from PubChem (CID 106689937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).