5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide

C12H11ClN2O3 — CID 82344272

IUPAC5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(N)o2)cc1Cl
InChIInChI=1S/C12H11ClN2O3/c1-17-9-3-2-7(6-8(9)13)15-12(16)10-4-5-11(14)18-10/h2-6H,14H2,1H3,(H,15,16)
InChIKeyXAYYDRANUOYXOK-UHFFFAOYSA-N
MW266.68 g/mol
LogP2.78
Rot. Bonds3

About 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide

5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide (PubChem CID 82344272) has the molecular formula C12H11ClN2O3 and a molecular weight of 266.68 g/mol. Its IUPAC name is 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide
PubChem CID82344272
Molecular FormulaC12H11ClN2O3
Molecular Weight266.68 g/mol
Exact Mass266.05
IUPAC Name5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(N)o2)cc1Cl
InChIInChI=1S/C12H11ClN2O3/c1-17-9-3-2-7(6-8(9)13)15-12(16)10-4-5-11(14)18-10/h2-6H,14H2,1H3,(H,15,16)
InChIKeyXAYYDRANUOYXOK-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

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 7341802
7-bromo-N-(3-chloro-4-methoxyphenyl)-4-oxochromene-2-carboxamide
CID 35180956
N-(3-chloro-4-methoxyphenyl)-5-[(2,5-dimethoxyphenyl)methyl]furan-2-carboxamide
CID 21047655
N-(3-chloro-4-methoxyphenyl)-4-ethylbenzamide
CID 2540642
N-(3-amino-4-methoxyphenyl)-5-methylfuran-2-carboxamide
CID 43599890
N-(4-acetamidophenyl)-5-aminofuran-2-carboxamide
CID 82344374
methyl 4-[(5-aminofuran-2-carbonyl)amino]benzoate
CID 82344340
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
N-(3-chloro-4-methoxyphenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 2470130
6-amino-N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide
CID 62060820
2-amino-N-(3-chloro-4-methoxyphenyl)pyridine-4-carboxamide
CID 55043717
N-[(3-chloro-4-methoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide
CID 1342731

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide (CID 82344272) is 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide is COc1ccc(NC(=O)c2ccc(N)o2)cc1Cl.
What is the InChIKey of 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide?
The InChIKey is XAYYDRANUOYXOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O3/c1-17-9-3-2-7(6-8(9)13)15-12(16)10-4-5-11(14)18-10/h2-6H,14H2,1H3,(H,15,16).
What are the key properties of 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide?
5-amino-N-(3-chloro-4-methoxyphenyl)furan-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 5-amino-N-(3-chloro-4-methoxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 82344272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).