N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide

C9H11BrN2O3 — CID 130961965

IUPACN-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide
SMILESCc1oc(Br)cc1C(=O)N[C@H](C)C(N)=O
InChIInChI=1S/C9H11BrN2O3/c1-4(8(11)13)12-9(14)6-3-7(10)15-5(6)2/h3-4H,1-2H3,(H2,11,13)(H,12,14)/t4-/m1/s1
InChIKeyHDMXLGKMJOOOJM-SCSAIBSYSA-N
MW275.10 g/mol
LogP0.95
Rot. Bonds3

About N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide

N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide (PubChem CID 130961965) has the molecular formula C9H11BrN2O3 and a molecular weight of 275.10 g/mol. Its IUPAC name is N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide
PubChem CID130961965
Molecular FormulaC9H11BrN2O3
Molecular Weight275.10 g/mol
Exact Mass274.00
IUPAC NameN-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide
SMILESCc1oc(Br)cc1C(=O)N[C@H](C)C(N)=O
InChIInChI=1S/C9H11BrN2O3/c1-4(8(11)13)12-9(14)6-3-7(10)15-5(6)2/h3-4H,1-2H3,(H2,11,13)(H,12,14)/t4-/m1/s1
InChIKeyHDMXLGKMJOOOJM-SCSAIBSYSA-N
XLogP0.95
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.10
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-1-amino-1-oxopropan-2-yl]-2-bromo-5-methylbenzamide
CID 171385167
N-(1-amino-1-oxopropan-2-yl)-2-bromo-5-methylbenzamide
CID 80980301
N-(1-amino-1-oxopropan-2-yl)-5-bromo-2-methylbenzamide
CID 65307034
5-bromo-N-ethyl-2-methylfuran-3-carboxamide
CID 130987082
ethyl 2-[(2,5-dimethylfuran-3-carbonyl)amino]propanoate
CID 61343316
N-(1-amino-1-oxopropan-2-yl)-2-bromo-4-chlorobenzamide
CID 103763560
2,5-dimethyl-N-(3-methylbutan-2-yl)furan-3-carboxamide
CID 18712127
5-amino-N-(1-amino-1-oxopropan-2-yl)-2-bromo-4-fluorobenzamide
CID 55118572
N-[(2S)-1-amino-1-oxopropan-2-yl]-3-bromopyridine-4-carboxamide
CID 131186254
N-[(2R)-1-amino-1-oxopropan-2-yl]-3-bromo-4-methylbenzamide
CID 171390408
methyl 2-[(2-bromo-5-methylbenzoyl)amino]propanoate
CID 81109488
N-[(2R)-1-amino-1-oxopropan-2-yl]-2-bromo-3-chlorobenzamide
CID 171390393

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide?
The IUPAC name of N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide (CID 130961965) is N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide is Cc1oc(Br)cc1C(=O)N[C@H](C)C(N)=O.
What is the InChIKey of N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide?
The InChIKey is HDMXLGKMJOOOJM-SCSAIBSYSA-N. The full InChI is InChI=1S/C9H11BrN2O3/c1-4(8(11)13)12-9(14)6-3-7(10)15-5(6)2/h3-4H,1-2H3,(H2,11,13)(H,12,14)/t4-/m1/s1.
What are the key properties of N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide?
N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide has a molecular weight of 275.10 g/mol, XLogP of 0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-amino-1-oxopropan-2-yl]-5-bromo-2-methylfuran-3-carboxamide is sourced from PubChem (CID 130961965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).