1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride

C7H13ClN2O2 — CID 74890040

IUPAC1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride
SMILESCl.O=C1NCC2(CCCNC2)O1
InChIInChI=1S/C7H12N2O2.ClH/c10-6-9-5-7(11-6)2-1-3-8-4-7;/h8H,1-5H2,(H,9,10);1H
InChIKeyJQVQEVZRMZRUEA-UHFFFAOYSA-N
MW192.65 g/mol
LogP0.27
Rot. Bonds

About 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride

1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride (PubChem CID 74890040) has the molecular formula C7H13ClN2O2 and a molecular weight of 192.65 g/mol. Its IUPAC name is 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride.

Molecular Properties

Compound Name1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride
PubChem CID74890040
Molecular FormulaC7H13ClN2O2
Molecular Weight192.65 g/mol
Exact Mass192.07
IUPAC Name1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride
SMILESCl.O=C1NCC2(CCCNC2)O1
InChIInChI=1S/C7H12N2O2.ClH/c10-6-9-5-7(11-6)2-1-3-8-4-7;/h8H,1-5H2,(H,9,10);1H
InChIKeyJQVQEVZRMZRUEA-UHFFFAOYSA-N
XLogP0.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.65
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Oxa-3,8-diazaspiro[4.5]decan-2-one hydrochloride
CID 50944313
1-Oxa-3,8-diazaspiro(4.5)decan 2-one
CID 12954114
3-Oxa-1,8-diazaspiro(4.5)decan-2-one hydrochloride
CID 75480642
3a,5-dimethyl-4,6,7,7a-tetrahydro-1H-[1,3]oxazolo[5,4-c]pyridin-2-one
CID 18685023
1-Oxa-3-aza-8-azoniaspiro[4.5]decan-2-one
CID 51371515
1-Oxa-3,7-diazaspiro[4.5]decan-2-one
CID 56698909
Tert-butyl 2-oxo-1-oxa-3,7-diazaspiro[4.5]decane-7-carboxylate
CID 67357095
9-Methyl-1-oxa-3,9-diazaspiro[4.5]decan-2-one
CID 81714458
3-Tert-butyl-1-oxa-3,7-diazaspiro[4.5]decan-2-one
CID 84122928
6-Oxa-2,8-diazaspiro[4.5]decan-7-one
CID 84763730
(R)-1-Oxa-3,7-diazaspiro[4.5]decan-2-one
CID 86327833
(5S)-1-oxa-3,9-diazaspiro[4.5]decan-2-one
CID 86327835

Frequently Asked Questions

What is the IUPAC name of 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride?
The IUPAC name of 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride (CID 74890040) is 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride.
What is the SMILES notation for 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride?
The canonical SMILES for 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride is Cl.O=C1NCC2(CCCNC2)O1.
What is the InChIKey of 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride?
The InChIKey is JQVQEVZRMZRUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2.ClH/c10-6-9-5-7(11-6)2-1-3-8-4-7;/h8H,1-5H2,(H,9,10);1H.
What are the key properties of 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride?
1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride has a molecular weight of 192.65 g/mol, XLogP of 0.27, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxa-3,9-diazaspiro[4.5]decan-2-one;hydrochloride is sourced from PubChem (CID 74890040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).