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

C12H10ClNO3 — CID 17015569

IUPACN-(5-chloro-2-methoxyphenyl)furan-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccoc1
InChIInChI=1S/C12H10ClNO3/c1-16-11-3-2-9(13)6-10(11)14-12(15)8-4-5-17-7-8/h2-7H,1H3,(H,14,15)
InChIKeyGEHLTVINDZQXEN-UHFFFAOYSA-N
MW251.67 g/mol
LogP3.19
Rot. Bonds3

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

N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide (PubChem CID 17015569) has the molecular formula C12H10ClNO3 and a molecular weight of 251.67 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)furan-3-carboxamide
PubChem CID17015569
Molecular FormulaC12H10ClNO3
Molecular Weight251.67 g/mol
Exact Mass251.03
IUPAC NameN-(5-chloro-2-methoxyphenyl)furan-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccoc1
InChIInChI=1S/C12H10ClNO3/c1-16-11-3-2-9(13)6-10(11)14-12(15)8-4-5-17-7-8/h2-7H,1H3,(H,14,15)
InChIKeyGEHLTVINDZQXEN-UHFFFAOYSA-N
XLogP3.19
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.67
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide (CID 17015569) is N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide is COc1ccc(Cl)cc1NC(=O)c1ccoc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide?
The InChIKey is GEHLTVINDZQXEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO3/c1-16-11-3-2-9(13)6-10(11)14-12(15)8-4-5-17-7-8/h2-7H,1H3,(H,14,15).
What are the key properties of N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide?
N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide has a molecular weight of 251.67 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide is sourced from PubChem (CID 17015569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).