11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide

C18H30N4O3 — CID 155900523

IUPAC11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide
SMILESCC(=O)N1CCC2(CC1)CC1(CCN(C(=O)N(C)C)CC1)C(=O)N2C
InChIInChI=1S/C18H30N4O3/c1-14(23)21-11-7-18(8-12-21)13-17(15(24)20(18)4)5-9-22(10-6-17)16(25)19(2)3/h5-13H2,1-4H3
InChIKeyGRAQMYTUCMKUBP-UHFFFAOYSA-N
MW350.46 g/mol
LogP0.99
Rot. Bonds

About 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide

11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide (PubChem CID 155900523) has the molecular formula C18H30N4O3 and a molecular weight of 350.46 g/mol. Its IUPAC name is 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide.

Molecular Properties

Compound Name11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide
PubChem CID155900523
Molecular FormulaC18H30N4O3
Molecular Weight350.46 g/mol
Exact Mass350.23
IUPAC Name11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide
SMILESCC(=O)N1CCC2(CC1)CC1(CCN(C(=O)N(C)C)CC1)C(=O)N2C
InChIInChI=1S/C18H30N4O3/c1-14(23)21-11-7-18(8-12-21)13-17(15(24)20(18)4)5-9-22(10-6-17)16(25)19(2)3/h5-13H2,1-4H3
InChIKeyGRAQMYTUCMKUBP-UHFFFAOYSA-N
XLogP0.99
TPSA64.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide?
The IUPAC name of 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide (CID 155900523) is 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide.
What is the SMILES notation for 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide?
The canonical SMILES for 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide is CC(=O)N1CCC2(CC1)CC1(CCN(C(=O)N(C)C)CC1)C(=O)N2C.
What is the InChIKey of 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide?
The InChIKey is GRAQMYTUCMKUBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O3/c1-14(23)21-11-7-18(8-12-21)13-17(15(24)20(18)4)5-9-22(10-6-17)16(25)19(2)3/h5-13H2,1-4H3.
What are the key properties of 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide?
11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 0.99, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-acetyl-N,N,14-trimethyl-15-oxo-3,11,14-triazadispiro[5.1.58.26]pentadecane-3-carboxamide is sourced from PubChem (CID 155900523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).