N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide

C14H14ClNO4 — CID 1244294

IUPACN-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide
SMILESCOc1cc(OC)c(NC(=O)c2ccoc2C)cc1Cl
InChIInChI=1S/C14H14ClNO4/c1-8-9(4-5-20-8)14(17)16-11-6-10(15)12(18-2)7-13(11)19-3/h4-7H,1-3H3,(H,16,17)
InChIKeyHHFOISBTMOMWKO-UHFFFAOYSA-N
MW295.72 g/mol
LogP3.51
Rot. Bonds4

About N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide

N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide (PubChem CID 1244294) has the molecular formula C14H14ClNO4 and a molecular weight of 295.72 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide
PubChem CID1244294
Molecular FormulaC14H14ClNO4
Molecular Weight295.72 g/mol
Exact Mass295.06
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide
SMILESCOc1cc(OC)c(NC(=O)c2ccoc2C)cc1Cl
InChIInChI=1S/C14H14ClNO4/c1-8-9(4-5-20-8)14(17)16-11-6-10(15)12(18-2)7-13(11)19-3/h4-7H,1-3H3,(H,16,17)
InChIKeyHHFOISBTMOMWKO-UHFFFAOYSA-N
XLogP3.51
TPSA60.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.72
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-methylfuran-3-carboxamide
CID 844961
N-(5-chloro-2,4-dimethoxyphenyl)-2-furamide
CID 836314
N-(5-Chloro-2,4-dimethoxyphenyl)-3,6-dimethyl-4-oxo-3H,4H-furo[2,3-D]pyrimidine-5-carboxamide
CID 16009468
N-(2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide
CID 896811
N-(5-Chloro-2,4-dimethoxyphenyl)-3-(2-furyl)-2-propenamide
CID 7275242
N-(4-chloro-2,5-dimethoxyphenyl)-2-methylfuran-3-carboxamide
CID 737668
N-(3-chloro-4-methoxyphenyl)-2-methylfuran-3-carboxamide
CID 1071662
N-(5-chloro-2-methoxyphenyl)furan-3-carboxamide
CID 17015569
N-(3-chloro-4-methoxyphenyl)furan-3-carboxamide
CID 16388075
N-(5-chloro-2,4-dimethoxyphenyl)benzamide
CID 835257
N-(2-(2,4-dichlorophenoxy)phenyl)-2,5-dimethylfuran-3-carboxamide
CID 168356065
N-[3-chloro-4-(difluoromethoxy)phenyl]furan-3-carboxamide
CID 17466014

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide (CID 1244294) is N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide is COc1cc(OC)c(NC(=O)c2ccoc2C)cc1Cl.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide?
The InChIKey is HHFOISBTMOMWKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO4/c1-8-9(4-5-20-8)14(17)16-11-6-10(15)12(18-2)7-13(11)19-3/h4-7H,1-3H3,(H,16,17).
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide?
N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide has a molecular weight of 295.72 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,4-dimethoxyphenyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 1244294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).