1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride

C14H29ClN2O — CID 119933414

IUPAC1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride
SMILESCC(C)OCCN1CCNCC12CCCCC2.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-13(2)17-11-10-16-9-8-15-12-14(16)6-4-3-5-7-14;/h13,15H,3-12H2,1-2H3;1H
InChIKeyVUCYWTYTVHFLQR-UHFFFAOYSA-N
MW276.85 g/mol
LogP2.44
Rot. Bonds4

About 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride

1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride (PubChem CID 119933414) has the molecular formula C14H29ClN2O and a molecular weight of 276.85 g/mol. Its IUPAC name is 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride.

Molecular Properties

Compound Name1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride
PubChem CID119933414
Molecular FormulaC14H29ClN2O
Molecular Weight276.85 g/mol
Exact Mass276.20
IUPAC Name1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride
SMILESCC(C)OCCN1CCNCC12CCCCC2.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-13(2)17-11-10-16-9-8-15-12-14(16)6-4-3-5-7-14;/h13,15H,3-12H2,1-2H3;1H
InChIKeyVUCYWTYTVHFLQR-UHFFFAOYSA-N
XLogP2.44
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.85
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride?
The IUPAC name of 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride (CID 119933414) is 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride.
What is the SMILES notation for 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride?
The canonical SMILES for 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride is CC(C)OCCN1CCNCC12CCCCC2.Cl.
What is the InChIKey of 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride?
The InChIKey is VUCYWTYTVHFLQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O.ClH/c1-13(2)17-11-10-16-9-8-15-12-14(16)6-4-3-5-7-14;/h13,15H,3-12H2,1-2H3;1H.
What are the key properties of 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride?
1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride has a molecular weight of 276.85 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propan-2-yloxyethyl)-1,4-diazaspiro[5.5]undecane;hydrochloride is sourced from PubChem (CID 119933414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).