7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one

C13H23N3O2 — CID 155067148

IUPAC7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one
SMILESCN1CCC(CN2CC3(C2)CN(C)C(=O)O3)CC1
InChIInChI=1S/C13H23N3O2/c1-14-5-3-11(4-6-14)7-16-9-13(10-16)8-15(2)12(17)18-13/h11H,3-10H2,1-2H3
InChIKeyOLZXQSOVWMITSG-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.46
Rot. Bonds2

About 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one

7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one (PubChem CID 155067148) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one.

Molecular Properties

Compound Name7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one
PubChem CID155067148
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one
SMILESCN1CCC(CN2CC3(C2)CN(C)C(=O)O3)CC1
InChIInChI=1S/C13H23N3O2/c1-14-5-3-11(4-6-14)7-16-9-13(10-16)8-15(2)12(17)18-13/h11H,3-10H2,1-2H3
InChIKeyOLZXQSOVWMITSG-UHFFFAOYSA-N
XLogP0.46
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one with MolForge

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Related Compounds

6-methyl-2-[(1-methylpiperidin-4-yl)methyl]-2,6-diazaspiro[3.3]heptane
CID 156719594
3,9-dimethyl-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
CID 159740354
1-[(1-methylazetidin-3-yl)methyl]-4-[(1-methylpiperidin-4-yl)methyl]piperazine
CID 169319865
methyl-[4-[(1-methylpiperidin-4-yl)methyl]piperazin-1-yl]silane
CID 174027762
2,3a-dimethyl-5-[(1-methylpiperidin-4-yl)methyl]-3,4,6,6a-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 167009734
1-[2-(1-methylpiperidin-4-yl)ethyl]piperidin-4-one
CID 114515872
1-[(1-methylpyrrolidin-3-yl)methyl]piperidin-4-one
CID 60854921
4-methyl-1-[(1-methylpiperidin-4-yl)methyl]piperazin-2-one
CID 155150634
1,2,6-trimethyl-4-[(1-methylpiperidin-4-yl)methyl]piperazine
CID 155218428
5-methyl-2-[(1-methylpiperidin-4-yl)methyl]-3,3a,4,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridine
CID 162741705
8-(cyclopentylmethyl)-3-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 70709572
1-cyclobutyl-6-[(1-methylpiperidin-4-yl)methyl]-1,6-diazaspiro[3.3]heptane;methanol
CID 156719939

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one?
The IUPAC name of 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one (CID 155067148) is 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one.
What is the SMILES notation for 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one?
The canonical SMILES for 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one is CN1CCC(CN2CC3(C2)CN(C)C(=O)O3)CC1.
What is the InChIKey of 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one?
The InChIKey is OLZXQSOVWMITSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-14-5-3-11(4-6-14)7-16-9-13(10-16)8-15(2)12(17)18-13/h11H,3-10H2,1-2H3.
What are the key properties of 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one?
7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one has a molecular weight of 253.35 g/mol, XLogP of 0.46, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-[(1-methylpiperidin-4-yl)methyl]-5-oxa-2,7-diazaspiro[3.4]octan-6-one is sourced from PubChem (CID 155067148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).