(8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol

C9H17NO3 — CID 22967056

IUPAC(8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol
SMILESCN1CCC2(CC1)OCC(CO)O2
InChIInChI=1S/C9H17NO3/c1-10-4-2-9(3-5-10)12-7-8(6-11)13-9/h8,11H,2-7H2,1H3
InChIKeyHDCPZPBFTZOXIN-UHFFFAOYSA-N
MW187.24 g/mol
LogP-0.18
Rot. Bonds1

About (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol

(8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol (PubChem CID 22967056) has the molecular formula C9H17NO3 and a molecular weight of 187.24 g/mol. Its IUPAC name is (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol.

Molecular Properties

Compound Name(8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol
PubChem CID22967056
Molecular FormulaC9H17NO3
Molecular Weight187.24 g/mol
Exact Mass187.12
IUPAC Name(8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol
SMILESCN1CCC2(CC1)OCC(CO)O2
InChIInChI=1S/C9H17NO3/c1-10-4-2-9(3-5-10)12-7-8(6-11)13-9/h8,11H,2-7H2,1H3
InChIKeyHDCPZPBFTZOXIN-UHFFFAOYSA-N
XLogP-0.18
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol?
The IUPAC name of (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol (CID 22967056) is (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol.
What is the SMILES notation for (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol?
The canonical SMILES for (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol is CN1CCC2(CC1)OCC(CO)O2.
What is the InChIKey of (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol?
The InChIKey is HDCPZPBFTZOXIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO3/c1-10-4-2-9(3-5-10)12-7-8(6-11)13-9/h8,11H,2-7H2,1H3.
What are the key properties of (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol?
(8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol has a molecular weight of 187.24 g/mol, XLogP of -0.18, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methyl-1,4-dioxa-8-azaspiro[4.5]decan-3-yl)methanol is sourced from PubChem (CID 22967056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).