N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide

C12H11ClN2O3 — CID 63258039

IUPACN-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide
SMILESCOc1ccc(N)c(NC(=O)c2ccc(Cl)o2)c1
InChIInChI=1S/C12H11ClN2O3/c1-17-7-2-3-8(14)9(6-7)15-12(16)10-4-5-11(13)18-10/h2-6H,14H2,1H3,(H,15,16)
InChIKeyJOHPVWIOBXWUDC-UHFFFAOYSA-N
MW266.68 g/mol
LogP2.78
Rot. Bonds3

About N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide

N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide (PubChem CID 63258039) has the molecular formula C12H11ClN2O3 and a molecular weight of 266.68 g/mol. Its IUPAC name is N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide
PubChem CID63258039
Molecular FormulaC12H11ClN2O3
Molecular Weight266.68 g/mol
Exact Mass266.05
IUPAC NameN-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide
SMILESCOc1ccc(N)c(NC(=O)c2ccc(Cl)o2)c1
InChIInChI=1S/C12H11ClN2O3/c1-17-7-2-3-8(14)9(6-7)15-12(16)10-4-5-11(13)18-10/h2-6H,14H2,1H3,(H,15,16)
InChIKeyJOHPVWIOBXWUDC-UHFFFAOYSA-N
XLogP2.78
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.68
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromo-5-methoxyphenyl)-5-ethylfuran-2-carboxamide
CID 78989438
5-bromo-N-(2-bromo-5-methoxyphenyl)furan-2-carboxamide
CID 51130825
N-(2-amino-5-methoxyphenyl)-2,6-dichlorobenzamide
CID 63257918
N-(6-amino-1,3-benzodioxol-5-yl)-5-chlorofuran-2-carboxamide
CID 103807343
N-(2-amino-4-methoxyphenyl)-5-(3-chloro-4-methoxyphenyl)furan-2-carboxamide
CID 91687544
N-(2-amino-5-methoxyphenyl)-4-chloro-3-methylbenzamide
CID 115736440
N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide
CID 107697705
N-(2-amino-5-methoxyphenyl)-5-methylthiophene-2-carboxamide
CID 63258266
5-(4-chlorophenyl)-N-(2,5-dimethoxyphenyl)furan-2-carboxamide
CID 3393060
N-(2-amino-5-methoxyphenyl)-4-[(4-methylpiperazin-1-yl)methyl]benzamide
CID 119420648
N-(2-amino-5-methoxyphenyl)-4-methyl-1,2-oxazole-5-carboxamide
CID 66334365
N-(2-amino-5-methoxyphenyl)-3-fluorobenzamide
CID 63258141

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide?
The IUPAC name of N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide (CID 63258039) is N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide.
What is the SMILES notation for N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide?
The canonical SMILES for N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide is COc1ccc(N)c(NC(=O)c2ccc(Cl)o2)c1.
What is the InChIKey of N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide?
The InChIKey is JOHPVWIOBXWUDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O3/c1-17-7-2-3-8(14)9(6-7)15-12(16)10-4-5-11(13)18-10/h2-6H,14H2,1H3,(H,15,16).
What are the key properties of N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide?
N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide has a molecular weight of 266.68 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide is sourced from PubChem (CID 63258039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).