14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide

C24H35N5O3 — CID 97439281

IUPAC14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide
SMILESCCN1C(=O)C2(CCN(C(=O)N(C)C)CC2)CC12CCN(C(=O)Nc1ccccc1)CC2
InChIInChI=1S/C24H35N5O3/c1-4-29-20(30)23(10-14-28(15-11-23)22(32)26(2)3)18-24(29)12-16-27(17-13-24)21(31)25-19-8-6-5-7-9-19/h5-9H,4,10-18H2,1-3H3,(H,25,31)
InChIKeyDTYPCZPIOBVBJV-UHFFFAOYSA-N
MW441.58 g/mol
LogP3.07
Rot. Bonds2

About 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide

14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide (PubChem CID 97439281) has the molecular formula C24H35N5O3 and a molecular weight of 441.58 g/mol. Its IUPAC name is 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide.

Molecular Properties

Compound Name14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide
PubChem CID97439281
Molecular FormulaC24H35N5O3
Molecular Weight441.58 g/mol
Exact Mass441.27
IUPAC Name14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide
SMILESCCN1C(=O)C2(CCN(C(=O)N(C)C)CC2)CC12CCN(C(=O)Nc1ccccc1)CC2
InChIInChI=1S/C24H35N5O3/c1-4-29-20(30)23(10-14-28(15-11-23)22(32)26(2)3)18-24(29)12-16-27(17-13-24)21(31)25-19-8-6-5-7-9-19/h5-9H,4,10-18H2,1-3H3,(H,25,31)
InChIKeyDTYPCZPIOBVBJV-UHFFFAOYSA-N
XLogP3.07
TPSA76.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.58
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-13-N,13-N-dimethyl-4-oxo-9-N-phenyl-3,9,13-triazadispiro[4.0.56.35]tetradecane-9,13-dicarboxamide
CID 131654262
4,4-dimethyl-N-phenylpiperidine-1-carboxamide
CID 110749467
(3aR,6aS)-5-ethyl-1-N'-(4-ethylphenyl)-2-N,2-N-dimethyl-6-oxospiro[1,3,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-4,4'-piperidine]-1',2-dicarboxamide
CID 125227195
2-[(4-methoxyphenyl)methyl]-3-oxo-N-phenyl-2,7-diazaspiro[3.5]nonane-7-carboxamide
CID 91909934
(5R)-3-ethyl-9-N-(4-fluorophenyl)-13-N,13-N-dimethyl-4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-9,13-dicarboxamide
CID 97440007
6-ethyl-8-oxo-N-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide
CID 131645592
4-[methyl(propan-2-yl)amino]-N-phenylpiperidine-1-carboxamide
CID 3451208
11-(4-chlorobenzoyl)-14-ethyl-3-(2-methylpropyl)-3,11,14-triazadispiro[5.1.58.26]pentadecan-15-one
CID 97439265
(5R)-10-N,10-N-dimethyl-3-oxo-7-N-phenyl-2,7,10-triazaspiro[4.6]undecane-7,10-dicarboxamide
CID 97438924
5,7-dimethyl-4-oxo-N-phenylspiro[3H-chromene-2,4'-piperidine]-1'-carboxamide
CID 108782711
N-[[1-(dimethylcarbamoyl)piperidin-4-yl]methyl]-N'-phenyloxamide
CID 121020500
4-N-benzyl-1-N-(4-ethylphenyl)-4-methylpiperidine-1,4-dicarboxamide
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Frequently Asked Questions

What is the IUPAC name of 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide?
The IUPAC name of 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide (CID 97439281) is 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide.
What is the SMILES notation for 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide?
The canonical SMILES for 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide is CCN1C(=O)C2(CCN(C(=O)N(C)C)CC2)CC12CCN(C(=O)Nc1ccccc1)CC2.
What is the InChIKey of 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide?
The InChIKey is DTYPCZPIOBVBJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35N5O3/c1-4-29-20(30)23(10-14-28(15-11-23)22(32)26(2)3)18-24(29)12-16-27(17-13-24)21(31)25-19-8-6-5-7-9-19/h5-9H,4,10-18H2,1-3H3,(H,25,31).
What are the key properties of 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide?
14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide has a molecular weight of 441.58 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 14-ethyl-3-N,3-N-dimethyl-15-oxo-11-N-phenyl-3,11,14-triazadispiro[5.1.58.26]pentadecane-3,11-dicarboxamide is sourced from PubChem (CID 97439281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).