6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane

C10H17NO — CID 170583535

IUPAC6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane
SMILESCC1(CN2CC3(COC3)C2)CC1
InChIInChI=1S/C10H17NO/c1-9(2-3-9)4-11-5-10(6-11)7-12-8-10/h2-8H2,1H3
InChIKeyOEJINQMHSQKESS-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.12
Rot. Bonds2

About 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane

6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane (PubChem CID 170583535) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane
PubChem CID170583535
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane
SMILESCC1(CN2CC3(COC3)C2)CC1
InChIInChI=1S/C10H17NO/c1-9(2-3-9)4-11-5-10(6-11)7-12-8-10/h2-8H2,1H3
InChIKeyOEJINQMHSQKESS-UHFFFAOYSA-N
XLogP1.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Fluoromethyl)-1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
CID 172349323
6-[[2,2-Difluoro-1-(methoxymethyl)cyclopropyl]methyl]-2-oxa-6-azaspiro[3.3]heptane
CID 177009822
6-Butyl-2-oxa-6-azaspiro[3.3]heptane
CID 13778350
6-(2,2-Dimethylpropyl)-2-oxa-6-azaspiro[3.3]heptane
CID 58266684
6-Tert-butyl-2-oxa-6-azaspiro[3.3]heptane
CID 58441443
6-Propyl-2-oxa-6-azaspiro[3.3]heptane
CID 68346908
6-(3-Methylbutan-2-yl)-2-oxa-6-azaspiro[3.3]heptane
CID 89805140
6-[(2S)-butan-2-yl]-2-oxa-6-azaspiro[3.3]heptane
CID 89806359
6-(3,3-Dimethylbutyl)-2-oxa-6-azaspiro[3.3]heptane
CID 117704665
6-(3-Methylbutyl)-2-oxa-6-azaspiro[3.3]heptane
CID 118641840
6-(2-Methylpropyl)-2-oxa-6-azaspiro[3.3]heptane
CID 121401085
1-[[1-[(2-Methylpropan-2-yl)oxymethyl]cyclopropyl]methyl]azetidine
CID 129036997

Frequently Asked Questions

What is the IUPAC name of 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane?
The IUPAC name of 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane (CID 170583535) is 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane.
What is the SMILES notation for 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane?
The canonical SMILES for 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane is CC1(CN2CC3(COC3)C2)CC1.
What is the InChIKey of 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane?
The InChIKey is OEJINQMHSQKESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-9(2-3-9)4-11-5-10(6-11)7-12-8-10/h2-8H2,1H3.
What are the key properties of 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane?
6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane has a molecular weight of 167.25 g/mol, XLogP of 1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-methylcyclopropyl)methyl]-2-oxa-6-azaspiro[3.3]heptane is sourced from PubChem (CID 170583535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).