N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide

C8H15N3O — CID 142542161

IUPACN-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide
SMILESCCNC(=O)N1CC2(CNC2)C1
InChIInChI=1S/C8H15N3O/c1-2-10-7(12)11-5-8(6-11)3-9-4-8/h9H,2-6H2,1H3,(H,10,12)
InChIKeyBHEHCGOVMZUMFV-UHFFFAOYSA-N
MW169.23 g/mol
LogP-0.38
Rot. Bonds1

About N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide

N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide (PubChem CID 142542161) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide
PubChem CID142542161
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC NameN-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide
SMILESCCNC(=O)N1CC2(CNC2)C1
InChIInChI=1S/C8H15N3O/c1-2-10-7(12)11-5-8(6-11)3-9-4-8/h9H,2-6H2,1H3,(H,10,12)
InChIKeyBHEHCGOVMZUMFV-UHFFFAOYSA-N
XLogP-0.38
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide?
The IUPAC name of N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide (CID 142542161) is N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide.
What is the SMILES notation for N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide?
The canonical SMILES for N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide is CCNC(=O)N1CC2(CNC2)C1.
What is the InChIKey of N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide?
The InChIKey is BHEHCGOVMZUMFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-2-10-7(12)11-5-8(6-11)3-9-4-8/h9H,2-6H2,1H3,(H,10,12).
What are the key properties of N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide?
N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide has a molecular weight of 169.23 g/mol, XLogP of -0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,6-diazaspiro[3.3]heptane-2-carboxamide is sourced from PubChem (CID 142542161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).