N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide

C14H20N2O2 — CID 43595224

IUPACN-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCNC3(CCC3)C2)o1
InChIInChI=1S/C14H20N2O2/c1-10-3-4-12(18-10)13(17)16-11-5-8-15-14(9-11)6-2-7-14/h3-4,11,15H,2,5-9H2,1H3,(H,16,17)
InChIKeyYVYUWMBWOKITSN-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.99
Rot. Bonds2

About N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide

N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide (PubChem CID 43595224) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide
PubChem CID43595224
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide
SMILESCc1ccc(C(=O)NC2CCNC3(CCC3)C2)o1
InChIInChI=1S/C14H20N2O2/c1-10-3-4-12(18-10)13(17)16-11-5-8-15-14(9-11)6-2-7-14/h3-4,11,15H,2,5-9H2,1H3,(H,16,17)
InChIKeyYVYUWMBWOKITSN-UHFFFAOYSA-N
XLogP1.99
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide?
The IUPAC name of N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide (CID 43595224) is N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide.
What is the SMILES notation for N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide?
The canonical SMILES for N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide is Cc1ccc(C(=O)NC2CCNC3(CCC3)C2)o1.
What is the InChIKey of N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide?
The InChIKey is YVYUWMBWOKITSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-3-4-12(18-10)13(17)16-11-5-8-15-14(9-11)6-2-7-14/h3-4,11,15H,2,5-9H2,1H3,(H,16,17).
What are the key properties of N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide?
N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-azaspiro[3.5]nonan-8-yl)-5-methylfuran-2-carboxamide is sourced from PubChem (CID 43595224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).