N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide

C14H17N3O3 — CID 22511775

IUPACN-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide
SMILESCOCCNC(=O)c1oc2c(c1C)-c1[nH]ncc1CC2
InChIInChI=1S/C14H17N3O3/c1-8-11-10(4-3-9-7-16-17-12(9)11)20-13(8)14(18)15-5-6-19-2/h7H,3-6H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyHEDDPERJXRQQIC-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.45
Rot. Bonds4

About N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide

N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide (PubChem CID 22511775) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide
PubChem CID22511775
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC NameN-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide
SMILESCOCCNC(=O)c1oc2c(c1C)-c1[nH]ncc1CC2
InChIInChI=1S/C14H17N3O3/c1-8-11-10(4-3-9-7-16-17-12(9)11)20-13(8)14(18)15-5-6-19-2/h7H,3-6H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyHEDDPERJXRQQIC-UHFFFAOYSA-N
XLogP1.45
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide (CID 22511775) is N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide is COCCNC(=O)c1oc2c(c1C)-c1[nH]ncc1CC2.
What is the InChIKey of N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide?
The InChIKey is HEDDPERJXRQQIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-8-11-10(4-3-9-7-16-17-12(9)11)20-13(8)14(18)15-5-6-19-2/h7H,3-6H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide?
N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide has a molecular weight of 275.31 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-8-methyl-4,5-dihydro-1H-furo[2,3-g]indazole-7-carboxamide is sourced from PubChem (CID 22511775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).