7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one

C6H10N2O3 — CID 146326181

IUPAC7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one
SMILESCNN1CC2(COC2)OC1=O
InChIInChI=1S/C6H10N2O3/c1-7-8-2-6(3-10-4-6)11-5(8)9/h7H,2-4H2,1H3
InChIKeyNWCCNXKGMRGVAQ-UHFFFAOYSA-N
MW158.16 g/mol
LogP-0.66
Rot. Bonds1

About 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one

7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one (PubChem CID 146326181) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one.

Molecular Properties

Compound Name7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one
PubChem CID146326181
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one
SMILESCNN1CC2(COC2)OC1=O
InChIInChI=1S/C6H10N2O3/c1-7-8-2-6(3-10-4-6)11-5(8)9/h7H,2-4H2,1H3
InChIKeyNWCCNXKGMRGVAQ-UHFFFAOYSA-N
XLogP-0.66
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-0.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-ethyl-2,5-dioxa-7-azaspiro[3.4]octan-6-one
CID 146246264
7-propan-2-yl-2,5-dioxa-7-azaspiro[3.4]octan-6-one
CID 165131645
3-(2-aminoethyl)-1,7-dioxa-3-azaspiro[4.4]nonan-2-one
CID 105442058
[2-[3-[2-(4-ethylpiperazin-1-yl)ethyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-8-yl]-2-oxoethyl]urea
CID 70714433
3-(3-aminophenyl)-1,7-dioxa-3-azaspiro[4.4]nonan-2-one
CID 105494121
3,5-diethyl-5-methyl-1,3-oxazolidin-2-one
CID 22000696
3,9-dimethyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
CID 159740354
2-methyl-7-(2,2,2-trifluoroethyl)-5-oxa-2,7-diazaspiro[3.5]nonan-6-one
CID 118974319
8-[3-(3-fluorooxetan-3-yl)benzoyl]-3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 166328338
N-methyl-3,7-dioxa-9-azabicyclo[3.3.1]nonan-9-amine
CID 174341959
3-hexyl-8-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 70740474
2-(2-methyl-7-oxo-6-oxa-2,8-diazaspiro[4.5]decan-8-yl)acetic acid
CID 105485391

Frequently Asked Questions

What is the IUPAC name of 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one?
The IUPAC name of 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one (CID 146326181) is 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one.
What is the SMILES notation for 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one?
The canonical SMILES for 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one is CNN1CC2(COC2)OC1=O.
What is the InChIKey of 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one?
The InChIKey is NWCCNXKGMRGVAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c1-7-8-2-6(3-10-4-6)11-5(8)9/h7H,2-4H2,1H3.
What are the key properties of 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one?
7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one has a molecular weight of 158.16 g/mol, XLogP of -0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(methylamino)-2,5-dioxa-7-azaspiro[3.4]octan-6-one is sourced from PubChem (CID 146326181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).