ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate

C11H20N2O2 — CID 130016002

IUPACethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate
SMILESCCOC(=O)NC1CC2(CCNCC2)C1
InChIInChI=1S/C11H20N2O2/c1-2-15-10(14)13-9-7-11(8-9)3-5-12-6-4-11/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyUKLQBWLOPBPABR-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.26
Rot. Bonds2

About ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate

ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate (PubChem CID 130016002) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate.

Molecular Properties

Compound Nameethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate
PubChem CID130016002
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Nameethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate
SMILESCCOC(=O)NC1CC2(CCNCC2)C1
InChIInChI=1S/C11H20N2O2/c1-2-15-10(14)13-9-7-11(8-9)3-5-12-6-4-11/h9,12H,2-8H2,1H3,(H,13,14)
InChIKeyUKLQBWLOPBPABR-UHFFFAOYSA-N
XLogP1.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate?
The IUPAC name of ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate (CID 130016002) is ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate.
What is the SMILES notation for ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate?
The canonical SMILES for ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate is CCOC(=O)NC1CC2(CCNCC2)C1.
What is the InChIKey of ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate?
The InChIKey is UKLQBWLOPBPABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-2-15-10(14)13-9-7-11(8-9)3-5-12-6-4-11/h9,12H,2-8H2,1H3,(H,13,14).
What are the key properties of ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate?
ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate has a molecular weight of 212.29 g/mol, XLogP of 1.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(7-azaspiro[3.5]nonan-2-yl)carbamate is sourced from PubChem (CID 130016002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).