(8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone

C15H17N3O2 — CID 3413463

IUPAC(8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone
SMILESCc1c(C(=O)N2CCCC2)oc2c1-c1[nH]ncc1CC2
InChIInChI=1S/C15H17N3O2/c1-9-12-11(5-4-10-8-16-17-13(10)12)20-14(9)15(19)18-6-2-3-7-18/h8H,2-7H2,1H3,(H,16,17)
InChIKeyWLOZQAGIDQYAQF-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.31
Rot. Bonds1

About (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone

(8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone (PubChem CID 3413463) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone
PubChem CID3413463
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone
SMILESCc1c(C(=O)N2CCCC2)oc2c1-c1[nH]ncc1CC2
InChIInChI=1S/C15H17N3O2/c1-9-12-11(5-4-10-8-16-17-13(10)12)20-14(9)15(19)18-6-2-3-7-18/h8H,2-7H2,1H3,(H,16,17)
InChIKeyWLOZQAGIDQYAQF-UHFFFAOYSA-N
XLogP2.31
TPSA62.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone (CID 3413463) is (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone is Cc1c(C(=O)N2CCCC2)oc2c1-c1[nH]ncc1CC2.
What is the InChIKey of (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone?
The InChIKey is WLOZQAGIDQYAQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-9-12-11(5-4-10-8-16-17-13(10)12)20-14(9)15(19)18-6-2-3-7-18/h8H,2-7H2,1H3,(H,16,17).
What are the key properties of (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone?
(8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone has a molecular weight of 271.32 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methyl-4,5-dihydro-1H-furo[2,3-g]indazol-7-yl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 3413463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).