N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide

C13H11ClN2O4 — CID 106685995

IUPACN-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide
SMILESNC(=O)COc1ccc(NC(=O)c2ccoc2Cl)cc1
InChIInChI=1S/C13H11ClN2O4/c14-12-10(5-6-19-12)13(18)16-8-1-3-9(4-2-8)20-7-11(15)17/h1-6H,7H2,(H2,15,17)(H,16,18)
InChIKeyQDLYHAOWYYLISF-UHFFFAOYSA-N
MW294.69 g/mol
LogP2.05
Rot. Bonds5

About N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide

N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide (PubChem CID 106685995) has the molecular formula C13H11ClN2O4 and a molecular weight of 294.69 g/mol. Its IUPAC name is N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide.

Molecular Properties

Compound NameN-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide
PubChem CID106685995
Molecular FormulaC13H11ClN2O4
Molecular Weight294.69 g/mol
Exact Mass294.04
IUPAC NameN-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide
SMILESNC(=O)COc1ccc(NC(=O)c2ccoc2Cl)cc1
InChIInChI=1S/C13H11ClN2O4/c14-12-10(5-6-19-12)13(18)16-8-1-3-9(4-2-8)20-7-11(15)17/h1-6H,7H2,(H2,15,17)(H,16,18)
InChIKeyQDLYHAOWYYLISF-UHFFFAOYSA-N
XLogP2.05
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.69
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chloropyridine-4-carboxamide
CID 38383627
N-[4-[(2E)-2-amino-2-hydroxyiminoethoxy]phenyl]-2-bromofuran-3-carboxamide
CID 106855744
N-[4-(2-amino-2-oxoethoxy)phenyl]-1,3-thiazole-4-carboxamide
CID 62045992
3-amino-N-[4-(2-amino-2-oxoethoxy)phenyl]pyrazine-2-carboxamide
CID 30831083
N-[4-(2-amino-2-oxoethoxy)phenyl]-2-bromopyridine-4-carboxamide
CID 103752263
2-chloro-N-[4-(cyclopropanecarbonylamino)phenyl]furan-3-carboxamide
CID 106685634
4-(2-amino-2-oxoethoxy)-N-phenylbenzamide
CID 27166758
N-[4-(2-amino-2-oxoethoxy)phenyl]-6-bromopyridine-3-carboxamide
CID 66464099
2-chloro-N-pyrimidin-5-ylfuran-3-carboxamide
CID 106812415
3-amino-N-[4-(2-amino-2-oxoethoxy)phenyl]propanamide
CID 43707093
2-[4-[(2-methoxyacetyl)amino]phenoxy]acetamide
CID 47156560
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CID 71894350

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide?
The IUPAC name of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide (CID 106685995) is N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide.
What is the SMILES notation for N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide?
The canonical SMILES for N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide is NC(=O)COc1ccc(NC(=O)c2ccoc2Cl)cc1.
What is the InChIKey of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide?
The InChIKey is QDLYHAOWYYLISF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O4/c14-12-10(5-6-19-12)13(18)16-8-1-3-9(4-2-8)20-7-11(15)17/h1-6H,7H2,(H2,15,17)(H,16,18).
What are the key properties of N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide?
N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide has a molecular weight of 294.69 g/mol, XLogP of 2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-amino-2-oxoethoxy)phenyl]-2-chlorofuran-3-carboxamide is sourced from PubChem (CID 106685995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).