2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide

C10H14BrNO4 — CID 106899013

IUPAC2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide
SMILESCOCC(CCO)NC(=O)c1ccoc1Br
InChIInChI=1S/C10H14BrNO4/c1-15-6-7(2-4-13)12-10(14)8-3-5-16-9(8)11/h3,5,7,13H,2,4,6H2,1H3,(H,12,14)
InChIKeyDPYDRBSNWCVUON-UHFFFAOYSA-N
MW292.13 g/mol
LogP1.17
Rot. Bonds6

About 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide

2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide (PubChem CID 106899013) has the molecular formula C10H14BrNO4 and a molecular weight of 292.13 g/mol. Its IUPAC name is 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide
PubChem CID106899013
Molecular FormulaC10H14BrNO4
Molecular Weight292.13 g/mol
Exact Mass291.01
IUPAC Name2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide
SMILESCOCC(CCO)NC(=O)c1ccoc1Br
InChIInChI=1S/C10H14BrNO4/c1-15-6-7(2-4-13)12-10(14)8-3-5-16-9(8)11/h3,5,7,13H,2,4,6H2,1H3,(H,12,14)
InChIKeyDPYDRBSNWCVUON-UHFFFAOYSA-N
XLogP1.17
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.13
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-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

2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)-3-methylbenzamide
CID 103855412
4-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)-2-methylbenzamide
CID 103799241
2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)-5-sulfanylbenzamide
CID 106162864
N-(4-amino-1-methoxybutan-2-yl)-2-methylfuran-3-carboxamide
CID 106152130
2-chloro-5-hydroxy-N-(4-hydroxy-1-methoxybutan-2-yl)benzamide
CID 106153598
2-bromo-N-[(2R)-1-hydroxypropan-2-yl]furan-3-carboxamide
CID 106854999
N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
CID 103799473
2,5-dihydroxy-N-(4-hydroxy-1-methoxybutan-2-yl)benzamide
CID 114150801
2-bromo-N-(4-chlorobutan-2-yl)furan-3-carboxamide
CID 106856184
3-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-2-methylbenzamide
CID 106152007
N-(4-hydroxy-1-methoxybutan-2-yl)-2-iodo-3-methylbenzamide
CID 103851034
5-(aminomethyl)-N-(4-hydroxy-1-methoxybutan-2-yl)furan-2-carboxamide
CID 106160982

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide?
The IUPAC name of 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide (CID 106899013) is 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide.
What is the SMILES notation for 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide?
The canonical SMILES for 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide is COCC(CCO)NC(=O)c1ccoc1Br.
What is the InChIKey of 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide?
The InChIKey is DPYDRBSNWCVUON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNO4/c1-15-6-7(2-4-13)12-10(14)8-3-5-16-9(8)11/h3,5,7,13H,2,4,6H2,1H3,(H,12,14).
What are the key properties of 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide?
2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide has a molecular weight of 292.13 g/mol, XLogP of 1.17, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide is sourced from PubChem (CID 106899013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).