7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane

C10H19NO2 — CID 77393646

IUPAC7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane
SMILESCC(C)C1CC2(CN1C)OCCO2
InChIInChI=1S/C10H19NO2/c1-8(2)9-6-10(7-11(9)3)12-4-5-13-10/h8-9H,4-7H2,1-3H3
InChIKeyIEBRHPGUUMCDBC-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.09
Rot. Bonds1

About 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane

7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane (PubChem CID 77393646) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane.

Molecular Properties

Compound Name7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane
PubChem CID77393646
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane
SMILESCC(C)C1CC2(CN1C)OCCO2
InChIInChI=1S/C10H19NO2/c1-8(2)9-6-10(7-11(9)3)12-4-5-13-10/h8-9H,4-7H2,1-3H3
InChIKeyIEBRHPGUUMCDBC-UHFFFAOYSA-N
XLogP1.09
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane?
The IUPAC name of 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane (CID 77393646) is 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane.
What is the SMILES notation for 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane?
The canonical SMILES for 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane is CC(C)C1CC2(CN1C)OCCO2.
What is the InChIKey of 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane?
The InChIKey is IEBRHPGUUMCDBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8(2)9-6-10(7-11(9)3)12-4-5-13-10/h8-9H,4-7H2,1-3H3.
What are the key properties of 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane?
7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane has a molecular weight of 185.27 g/mol, XLogP of 1.09, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-8-propan-2-yl-1,4-dioxa-7-azaspiro[4.4]nonane is sourced from PubChem (CID 77393646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).