N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide

C10H18N2O3 — CID 130905377

IUPACN-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide
SMILESCNCC(=O)NC1CCC2(C1)OCCO2
InChIInChI=1S/C10H18N2O3/c1-11-7-9(13)12-8-2-3-10(6-8)14-4-5-15-10/h8,11H,2-7H2,1H3,(H,12,13)
InChIKeyUTNHSUVQIMWXTA-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.38
Rot. Bonds3

About N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide

N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide (PubChem CID 130905377) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide
PubChem CID130905377
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC NameN-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide
SMILESCNCC(=O)NC1CCC2(C1)OCCO2
InChIInChI=1S/C10H18N2O3/c1-11-7-9(13)12-8-2-3-10(6-8)14-4-5-15-10/h8,11H,2-7H2,1H3,(H,12,13)
InChIKeyUTNHSUVQIMWXTA-UHFFFAOYSA-N
XLogP-0.38
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide?
The IUPAC name of N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide (CID 130905377) is N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide.
What is the SMILES notation for N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide?
The canonical SMILES for N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide is CNCC(=O)NC1CCC2(C1)OCCO2.
What is the InChIKey of N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide?
The InChIKey is UTNHSUVQIMWXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-11-7-9(13)12-8-2-3-10(6-8)14-4-5-15-10/h8,11H,2-7H2,1H3,(H,12,13).
What are the key properties of N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide?
N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide has a molecular weight of 214.26 g/mol, XLogP of -0.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide is sourced from PubChem (CID 130905377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).