10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide

C14H24N4O3 — CID 118740729

IUPAC10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide
SMILESCCN1CC2(CC1=O)CN(C(C)=O)CCN(C(=O)NC)C2
InChIInChI=1S/C14H24N4O3/c1-4-16-8-14(7-12(16)20)9-17(11(2)19)5-6-18(10-14)13(21)15-3/h4-10H2,1-3H3,(H,15,21)
InChIKeyOCNHWZFEOLWTMK-UHFFFAOYSA-N
MW296.37 g/mol
LogP-0.27
Rot. Bonds1

About 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide

10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide (PubChem CID 118740729) has the molecular formula C14H24N4O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide.

Molecular Properties

Compound Name10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide
PubChem CID118740729
Molecular FormulaC14H24N4O3
Molecular Weight296.37 g/mol
Exact Mass296.18
IUPAC Name10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide
SMILESCCN1CC2(CC1=O)CN(C(C)=O)CCN(C(=O)NC)C2
InChIInChI=1S/C14H24N4O3/c1-4-16-8-14(7-12(16)20)9-17(11(2)19)5-6-18(10-14)13(21)15-3/h4-10H2,1-3H3,(H,15,21)
InChIKeyOCNHWZFEOLWTMK-UHFFFAOYSA-N
XLogP-0.27
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-3-oxo-7-N,10-N-di(propan-2-yl)-2,7,10-triazaspiro[4.6]undecane-7,10-dicarboxamide
CID 97439083
3-oxo-7-N,10-N-di(propan-2-yl)-2,7,10-triazaspiro[4.6]undecane-7,10-dicarboxamide
CID 97522023
2-ethyl-N-methyl-7-methylsulfonyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118738915
N,2-dimethyl-7-(2-methylpropanoyl)-3-oxo-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118739144
N,N,2-trimethyl-7-(2-methylpropanoyl)-3-oxo-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118739546
7-acetyl-2-methyl-3-oxo-N-propan-2-yl-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118739549
7-N,10-N,10-N,2-tetramethyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7,10-dicarboxamide
CID 118739550
2-methyl-7-(3-methylbutanoyl)-3-oxo-N-propan-2-yl-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118739551
2-methyl-7-(2-methylpropanoyl)-3-oxo-N-propan-2-yl-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118739556
7-acetyl-3-oxo-N-propan-2-yl-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118739586
N,N,2-trimethyl-7-(3-methylbutanoyl)-3-oxo-2,7,10-triazaspiro[4.6]undecane-10-carboxamide
CID 118739780
10-N,10-N,2-trimethyl-3-oxo-7-N-propan-2-yl-2,7,10-triazaspiro[4.6]undecane-7,10-dicarboxamide
CID 118739783

Frequently Asked Questions

What is the IUPAC name of 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide?
The IUPAC name of 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide (CID 118740729) is 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide.
What is the SMILES notation for 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide?
The canonical SMILES for 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide is CCN1CC2(CC1=O)CN(C(C)=O)CCN(C(=O)NC)C2.
What is the InChIKey of 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide?
The InChIKey is OCNHWZFEOLWTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3/c1-4-16-8-14(7-12(16)20)9-17(11(2)19)5-6-18(10-14)13(21)15-3/h4-10H2,1-3H3,(H,15,21).
What are the key properties of 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide?
10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide has a molecular weight of 296.37 g/mol, XLogP of -0.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-acetyl-2-ethyl-N-methyl-3-oxo-2,7,10-triazaspiro[4.6]undecane-7-carboxamide is sourced from PubChem (CID 118740729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).