5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide

C17H16N4O4 — CID 87015415

IUPAC5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide
SMILESCOc1ccccc1OCc1ccc(C(=O)NNc2ncccn2)o1
InChIInChI=1S/C17H16N4O4/c1-23-13-5-2-3-6-14(13)24-11-12-7-8-15(25-12)16(22)20-21-17-18-9-4-10-19-17/h2-10H,11H2,1H3,(H,20,22)(H,18,19,21)
InChIKeyFGDAWFDKUDJUPU-UHFFFAOYSA-N
MW340.34 g/mol
LogP2.41
Rot. Bonds7

About 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide

5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide (PubChem CID 87015415) has the molecular formula C17H16N4O4 and a molecular weight of 340.34 g/mol. Its IUPAC name is 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide.

Molecular Properties

Compound Name5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide
PubChem CID87015415
Molecular FormulaC17H16N4O4
Molecular Weight340.34 g/mol
Exact Mass340.12
IUPAC Name5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide
SMILESCOc1ccccc1OCc1ccc(C(=O)NNc2ncccn2)o1
InChIInChI=1S/C17H16N4O4/c1-23-13-5-2-3-6-14(13)24-11-12-7-8-15(25-12)16(22)20-21-17-18-9-4-10-19-17/h2-10H,11H2,1H3,(H,20,22)(H,18,19,21)
InChIKeyFGDAWFDKUDJUPU-UHFFFAOYSA-N
XLogP2.41
TPSA98.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.34
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-[(2-methoxyphenoxy)methyl]-N-(2-methylpropyl)furan-2-carboxamide
CID 717010
5-[(2-methoxyphenoxy)methyl]-N-[(6-methyl-2-pyridinyl)methyl]furan-2-carboxamide
CID 87041704
N-[2-(ethylamino)-2-oxoethyl]-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 86997976
5-[(2-methoxyphenoxy)methyl]-N-(3,4,5-trimethoxyphenyl)furan-2-carboxamide
CID 3153929
N-(2-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 35529212
5-[(2-methoxyphenoxy)methyl]-N-(4-methylpiperazin-1-yl)furan-2-carboxamide
CID 3542536
N-(4-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19467513
5-[(2-methoxyphenoxy)methyl]-N-(pyridin-1-ium-3-ylmethyl)furan-2-carboxamide
CID 3660443
5-[(2-methoxyphenoxy)methyl]-N-[(1S)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 35529733
5-[(2-methoxyphenoxy)methyl]-N-[(1R)-1-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 35529730
5-[(2-methoxyphenoxy)methyl]-N-(1-methylbenzimidazol-2-yl)furan-2-carboxamide
CID 19467514
N-[4-(ethylsulfanylmethyl)-2-pyridinyl]-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 75470102

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide?
The IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide (CID 87015415) is 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide.
What is the SMILES notation for 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide?
The canonical SMILES for 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide is COc1ccccc1OCc1ccc(C(=O)NNc2ncccn2)o1.
What is the InChIKey of 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide?
The InChIKey is FGDAWFDKUDJUPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O4/c1-23-13-5-2-3-6-14(13)24-11-12-7-8-15(25-12)16(22)20-21-17-18-9-4-10-19-17/h2-10H,11H2,1H3,(H,20,22)(H,18,19,21).
What are the key properties of 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide?
5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide has a molecular weight of 340.34 g/mol, XLogP of 2.41, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxyphenoxy)methyl]-N'-pyrimidin-2-ylfuran-2-carbohydrazide is sourced from PubChem (CID 87015415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).