N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide

C18H22N4O2 — CID 22389428

IUPACN-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide
SMILESO=C(NC1CC2CNC1C2)c1cc2c(N3CCCC3)coc2cn1
InChIInChI=1S/C18H22N4O2/c23-18(21-14-6-11-5-13(14)19-8-11)15-7-12-16(22-3-1-2-4-22)10-24-17(12)9-20-15/h7,9-11,13-14,19H,1-6,8H2,(H,21,23)
InChIKeyFOHDSBHBSBLBJH-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.91
Rot. Bonds3

About N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide

N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide (PubChem CID 22389428) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide
PubChem CID22389428
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide
SMILESO=C(NC1CC2CNC1C2)c1cc2c(N3CCCC3)coc2cn1
InChIInChI=1S/C18H22N4O2/c23-18(21-14-6-11-5-13(14)19-8-11)15-7-12-16(22-3-1-2-4-22)10-24-17(12)9-20-15/h7,9-11,13-14,19H,1-6,8H2,(H,21,23)
InChIKeyFOHDSBHBSBLBJH-UHFFFAOYSA-N
XLogP1.91
TPSA70.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide?
The IUPAC name of N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide (CID 22389428) is N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide.
What is the SMILES notation for N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide?
The canonical SMILES for N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide is O=C(NC1CC2CNC1C2)c1cc2c(N3CCCC3)coc2cn1.
What is the InChIKey of N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide?
The InChIKey is FOHDSBHBSBLBJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c23-18(21-14-6-11-5-13(14)19-8-11)15-7-12-16(22-3-1-2-4-22)10-24-17(12)9-20-15/h7,9-11,13-14,19H,1-6,8H2,(H,21,23).
What are the key properties of N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide?
N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-azabicyclo[2.2.1]heptan-6-yl)-3-pyrrolidin-1-ylfuro[2,3-c]pyridine-5-carboxamide is sourced from PubChem (CID 22389428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).