2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide

C11H17N3O2 — CID 139371635

IUPAC2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide
SMILESNC(=O)CN1CCCC12CC=CCNC2=O
InChIInChI=1S/C11H17N3O2/c12-9(15)8-14-7-3-5-11(14)4-1-2-6-13-10(11)16/h1-2H,3-8H2,(H2,12,15)(H,13,16)
InChIKeyPDVGDLBOYGHDHD-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.62
Rot. Bonds2

About 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide

2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide (PubChem CID 139371635) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide.

Molecular Properties

Compound Name2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide
PubChem CID139371635
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide
SMILESNC(=O)CN1CCCC12CC=CCNC2=O
InChIInChI=1S/C11H17N3O2/c12-9(15)8-14-7-3-5-11(14)4-1-2-6-13-10(11)16/h1-2H,3-8H2,(H2,12,15)(H,13,16)
InChIKeyPDVGDLBOYGHDHD-UHFFFAOYSA-N
XLogP-0.62
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-acetyl-N-methyl-5-(2-methylpropyl)-2H-pyrrole-5-carboxamide
CID 5459653
N-[(E)-8-amino-2-methyl-8-oxooct-5-en-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 44386090
N-[(4-fluorocyclohex-3-en-1-yl)methyl]pyrrolidine-2-carboxamide
CID 172877858
1-acetyl-N-(cyclopropylmethyl)-5-(2-methylpropyl)-2H-pyrrole-5-carboxamide
CID 5459652
Tert-butyl 3,3-difluoro-11-oxo-1,10-diazaspiro[4.6]undec-7-ene-1-carboxylate
CID 139371742
3,3-Difluoro-1,10-diazaspiro[4.6]undec-7-en-11-one
CID 139371875
1,10-Diazaspiro[4.6]undec-7-en-11-one;2,2,2-trifluoroacetaldehyde
CID 139371919
1-(2,2,2-Trifluoroacetyl)-1,10-diazaspiro[4.6]undec-7-en-11-one
CID 139371920
(5S)-10-methyl-1,10-diazaspiro[4.6]undec-8-en-11-one
CID 134842991
(2R)-N,N-dimethyl-2-prop-2-enylpyrrolidine-2-carboxamide
CID 154720748
(2-ethylpyrrolidin-2-yl)-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CID 114489942
N-[2-(tert-butylamino)-2-oxoethyl]-2-cyclopent-2-en-1-ylacetamide
CID 18153592

Frequently Asked Questions

What is the IUPAC name of 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide?
The IUPAC name of 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide (CID 139371635) is 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide.
What is the SMILES notation for 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide?
The canonical SMILES for 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide is NC(=O)CN1CCCC12CC=CCNC2=O.
What is the InChIKey of 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide?
The InChIKey is PDVGDLBOYGHDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c12-9(15)8-14-7-3-5-11(14)4-1-2-6-13-10(11)16/h1-2H,3-8H2,(H2,12,15)(H,13,16).
What are the key properties of 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide?
2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide has a molecular weight of 223.28 g/mol, XLogP of -0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(11-oxo-1,10-diazaspiro[4.6]undec-7-en-1-yl)acetamide is sourced from PubChem (CID 139371635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).