N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide

C11H9ClN2O3 — CID 107697705

IUPACN-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide
SMILESNc1cc(O)ccc1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C11H9ClN2O3/c12-10-4-3-9(17-10)11(16)14-8-2-1-6(15)5-7(8)13/h1-5,15H,13H2,(H,14,16)
InChIKeyCTUZXEMGMQQYFP-UHFFFAOYSA-N
MW252.66 g/mol
LogP2.47
Rot. Bonds2

About N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide

N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide (PubChem CID 107697705) has the molecular formula C11H9ClN2O3 and a molecular weight of 252.66 g/mol. Its IUPAC name is N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide
PubChem CID107697705
Molecular FormulaC11H9ClN2O3
Molecular Weight252.66 g/mol
Exact Mass252.03
IUPAC NameN-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide
SMILESNc1cc(O)ccc1NC(=O)c1ccc(Cl)o1
InChIInChI=1S/C11H9ClN2O3/c12-10-4-3-9(17-10)11(16)14-8-2-1-6(15)5-7(8)13/h1-5,15H,13H2,(H,14,16)
InChIKeyCTUZXEMGMQQYFP-UHFFFAOYSA-N
XLogP2.47
TPSA88.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.66
LogP ≤ 52.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(6-amino-1,3-benzodioxol-5-yl)-5-chlorofuran-2-carboxamide
CID 103807343
N-(2-amino-4-bromophenyl)-5-methylfuran-2-carboxamide
CID 43130501
N-(2-amino-5-methoxyphenyl)-5-chlorofuran-2-carboxamide
CID 63258039
2-[(5-chlorofuran-2-carbonyl)amino]-5-methylbenzoic acid
CID 28791203
N-(4-bromo-2,6-difluorophenyl)-5-chlorofuran-2-carboxamide
CID 65498748
5-chloro-N-(3-hydroxy-2,4-dimethylphenyl)furan-2-carboxamide
CID 113290206
N-(2-carbamothioyl-5-chlorophenyl)-5-chlorofuran-2-carboxamide
CID 106684980
N-(2-amino-4-methylphenyl)-5-methylfuran-2-carboxamide
CID 43259016
5-chloro-N-(2-chloro-4,6-difluorophenyl)furan-2-carboxamide
CID 113343811
2-amino-N-(2,4-dichlorophenyl)-5-hydroxybenzamide
CID 107073840
N-(2-bromo-4-cyanophenyl)-5-chlorofuran-2-carboxamide
CID 113231347
N-(2-amino-4-bromophenyl)-5-(3-chloro-2-methylphenyl)furan-2-carboxamide
CID 91687495

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide?
The IUPAC name of N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide (CID 107697705) is N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide.
What is the SMILES notation for N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide?
The canonical SMILES for N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide is Nc1cc(O)ccc1NC(=O)c1ccc(Cl)o1.
What is the InChIKey of N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide?
The InChIKey is CTUZXEMGMQQYFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O3/c12-10-4-3-9(17-10)11(16)14-8-2-1-6(15)5-7(8)13/h1-5,15H,13H2,(H,14,16).
What are the key properties of N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide?
N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide has a molecular weight of 252.66 g/mol, XLogP of 2.47, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-hydroxyphenyl)-5-chlorofuran-2-carboxamide is sourced from PubChem (CID 107697705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).