5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide

C21H18N4O4 — CID 75358513

IUPAC5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
SMILESCOc1ccccc1OCc1ccc(C(=O)Nc2cc(-c3ccncc3)[nH]n2)o1
InChIInChI=1S/C21H18N4O4/c1-27-17-4-2-3-5-18(17)28-13-15-6-7-19(29-15)21(26)23-20-12-16(24-25-20)14-8-10-22-11-9-14/h2-12H,13H2,1H3,(H2,23,24,25,26)
InChIKeyQCNFKBNUMWQQAU-UHFFFAOYSA-N
MW390.40 g/mol
LogP3.90
Rot. Bonds7

About 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide

5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide (PubChem CID 75358513) has the molecular formula C21H18N4O4 and a molecular weight of 390.40 g/mol. Its IUPAC name is 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
PubChem CID75358513
Molecular FormulaC21H18N4O4
Molecular Weight390.40 g/mol
Exact Mass390.13
IUPAC Name5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
SMILESCOc1ccccc1OCc1ccc(C(=O)Nc2cc(-c3ccncc3)[nH]n2)o1
InChIInChI=1S/C21H18N4O4/c1-27-17-4-2-3-5-18(17)28-13-15-6-7-19(29-15)21(26)23-20-12-16(24-25-20)14-8-10-22-11-9-14/h2-12H,13H2,1H3,(H2,23,24,25,26)
InChIKeyQCNFKBNUMWQQAU-UHFFFAOYSA-N
XLogP3.90
TPSA102.27 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.40
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
CID 75358510
5-[(4-propan-2-ylphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
CID 95752870
N-[4-(ethylsulfanylmethyl)-2-pyridinyl]-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 75470102
5-[(2-methoxyphenoxy)methyl]-N-(3,4,5-trimethoxyphenyl)furan-2-carboxamide
CID 3153929
5-[(2-methoxyphenoxy)methyl]-N-[3-(1,3-oxazol-5-yl)phenyl]furan-2-carboxamide
CID 55990422
5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide
CID 87015415
N-(2-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 35529212
5-[(2-methoxyphenoxy)methyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 717010
N-(2,4-dichlorophenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 51781977
5-[(2-bromophenoxy)methyl]-N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]furan-2-carboxamide
CID 95755081
N-(4-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19467513
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 49168966

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
The IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide (CID 75358513) is 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide.
What is the SMILES notation for 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
The canonical SMILES for 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide is COc1ccccc1OCc1ccc(C(=O)Nc2cc(-c3ccncc3)[nH]n2)o1.
What is the InChIKey of 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
The InChIKey is QCNFKBNUMWQQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O4/c1-27-17-4-2-3-5-18(17)28-13-15-6-7-19(29-15)21(26)23-20-12-16(24-25-20)14-8-10-22-11-9-14/h2-12H,13H2,1H3,(H2,23,24,25,26).
What are the key properties of 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide has a molecular weight of 390.40 g/mol, XLogP of 3.90, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide is sourced from PubChem (CID 75358513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).