3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide

C10H18N2O3 — CID 131182035

IUPAC3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide
SMILESCNC(=O)CCN1CCC2(C1)OCCO2
InChIInChI=1S/C10H18N2O3/c1-11-9(13)2-4-12-5-3-10(8-12)14-6-7-15-10/h2-8H2,1H3,(H,11,13)
InChIKeyKCCQMDZFKBXCMK-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.43
Rot. Bonds3

About 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide

3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide (PubChem CID 131182035) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide.

Molecular Properties

Compound Name3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide
PubChem CID131182035
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide
SMILESCNC(=O)CCN1CCC2(C1)OCCO2
InChIInChI=1S/C10H18N2O3/c1-11-9(13)2-4-12-5-3-10(8-12)14-6-7-15-10/h2-8H2,1H3,(H,11,13)
InChIKeyKCCQMDZFKBXCMK-UHFFFAOYSA-N
XLogP-0.43
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-(3-methylbut-3-enyl)-1,4-dioxa-7-azaspiro[4.4]nonane
CID 130964518
3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-ethylpropanamide
CID 112726882
N-methyl-3-morpholin-4-ylpropanamide;hydrochloride
CID 45264777
7-(3,3,3-trifluoropropyl)-1,4-dioxa-7-azaspiro[4.4]nonane
CID 131182289
N-methyl-3-pyrrolidin-1-ylpropanamide
CID 20700879
3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(4-methylphenyl)propanamide
CID 109028499
1-(3-hydrazinyl-3-oxopropyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106322049
8-(3-methylbut-3-enyl)-1,4-dioxa-8-azaspiro[4.5]decane
CID 114448872
3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethylpropanamide
CID 109028480
3-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(4-methoxyphenyl)propanamide
CID 109028531
3-[(4R)-3,3-difluoro-4-methylpiperidin-1-yl]-N-methylpropanamide
CID 129349085
2-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-1-pyrrolidin-1-ylethanone
CID 131182071

Frequently Asked Questions

What is the IUPAC name of 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide?
The IUPAC name of 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide (CID 131182035) is 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide.
What is the SMILES notation for 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide?
The canonical SMILES for 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide is CNC(=O)CCN1CCC2(C1)OCCO2.
What is the InChIKey of 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide?
The InChIKey is KCCQMDZFKBXCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-11-9(13)2-4-12-5-3-10(8-12)14-6-7-15-10/h2-8H2,1H3,(H,11,13).
What are the key properties of 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide?
3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide has a molecular weight of 214.26 g/mol, XLogP of -0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)-N-methylpropanamide is sourced from PubChem (CID 131182035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).