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

C21H18N4O4 — CID 75358510

IUPAC5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
SMILESCOc1cccc(OCc2ccc(C(=O)Nc3cc(-c4ccncc4)[nH]n3)o2)c1
InChIInChI=1S/C21H18N4O4/c1-27-15-3-2-4-16(11-15)28-13-17-5-6-19(29-17)21(26)23-20-12-18(24-25-20)14-7-9-22-10-8-14/h2-12H,13H2,1H3,(H2,23,24,25,26)
InChIKeyFDIAUYIDYRQUMG-UHFFFAOYSA-N
MW390.40 g/mol
LogP3.90
Rot. Bonds7

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

5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide (PubChem CID 75358510) has the molecular formula C21H18N4O4 and a molecular weight of 390.40 g/mol. Its IUPAC name is 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
PubChem CID75358510
Molecular FormulaC21H18N4O4
Molecular Weight390.40 g/mol
Exact Mass390.13
IUPAC Name5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
SMILESCOc1cccc(OCc2ccc(C(=O)Nc3cc(-c4ccncc4)[nH]n3)o2)c1
InChIInChI=1S/C21H18N4O4/c1-27-15-3-2-4-16(11-15)28-13-17-5-6-19(29-17)21(26)23-20-12-18(24-25-20)14-7-9-22-10-8-14/h2-12H,13H2,1H3,(H2,23,24,25,26)
InChIKeyFDIAUYIDYRQUMG-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-[(2-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
CID 75358513
5-[(4-propan-2-ylphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide
CID 95752870
N-(2,3-dihydro-1H-inden-5-yl)-5-[(3-methoxyphenoxy)methyl]furan-2-carboxamide
CID 35524166
methyl 4-[[5-[(3-methoxyphenoxy)methyl]furan-2-carbonyl]amino]-1,5-dimethylpyrazole-3-carboxylate
CID 95748102
N-(6-methoxy-1,3-benzothiazol-2-yl)-5-[(3-methoxyphenoxy)methyl]furan-2-carboxamide
CID 35523457
5-[(3-methoxyphenoxy)methyl]-N-(2-nitrophenyl)furan-2-carboxamide
CID 19412725
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-N-(3-methoxyphenyl)furan-2-carboxamide
CID 19458853
N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 55826233
N-[4-bromo-1-[(4-chlorophenyl)methyl]pyrazol-3-yl]-5-[(3-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19284185
N-(3-acetylphenyl)-5-[(4-methoxyphenoxy)methyl]furan-2-carboxamide
CID 53054149
5-[(3,5-dimethoxyphenoxy)methyl]furan-2-carbohydrazide
CID 63570670
N-[1-[(2,4-dichlorophenyl)methyl]-5-methylpyrazol-3-yl]-5-[(3-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19337126

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
The IUPAC name of 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide (CID 75358510) is 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide.
What is the SMILES notation for 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
The canonical SMILES for 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide is COc1cccc(OCc2ccc(C(=O)Nc3cc(-c4ccncc4)[nH]n3)o2)c1.
What is the InChIKey of 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
The InChIKey is FDIAUYIDYRQUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O4/c1-27-15-3-2-4-16(11-15)28-13-17-5-6-19(29-17)21(26)23-20-12-18(24-25-20)14-7-9-22-10-8-14/h2-12H,13H2,1H3,(H2,23,24,25,26).
What are the key properties of 5-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide?
5-[(3-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-[(3-methoxyphenoxy)methyl]-N-(5-pyridin-4-yl-1H-pyrazol-3-yl)furan-2-carboxamide is sourced from PubChem (CID 75358510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).