2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane

C12H22N2 — CID 145006598

IUPAC2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane
SMILESCCN1CCC2(CCN(C3CC3)C2)C1
InChIInChI=1S/C12H22N2/c1-2-13-7-5-12(9-13)6-8-14(10-12)11-3-4-11/h11H,2-10H2,1H3
InChIKeyDLCDAWORMCWDLL-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.57
Rot. Bonds2

About 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane

2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane (PubChem CID 145006598) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane.

Molecular Properties

Compound Name2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane
PubChem CID145006598
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane
SMILESCCN1CCC2(CCN(C3CC3)C2)C1
InChIInChI=1S/C12H22N2/c1-2-13-7-5-12(9-13)6-8-14(10-12)11-3-4-11/h11H,2-10H2,1H3
InChIKeyDLCDAWORMCWDLL-UHFFFAOYSA-N
XLogP1.57
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane?
The IUPAC name of 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane (CID 145006598) is 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane.
What is the SMILES notation for 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane?
The canonical SMILES for 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane is CCN1CCC2(CCN(C3CC3)C2)C1.
What is the InChIKey of 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane?
The InChIKey is DLCDAWORMCWDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-2-13-7-5-12(9-13)6-8-14(10-12)11-3-4-11/h11H,2-10H2,1H3.
What are the key properties of 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane?
2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane has a molecular weight of 194.32 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-7-ethyl-2,7-diazaspiro[4.4]nonane is sourced from PubChem (CID 145006598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).