N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide

C20H28N4O2 — CID 131649936

IUPACN-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide
SMILESCN1CC(=O)N(c2ccccc2)CC12CCN(C(=O)NC1CCCC1)C2
InChIInChI=1S/C20H28N4O2/c1-22-13-18(25)24(17-9-3-2-4-10-17)15-20(22)11-12-23(14-20)19(26)21-16-7-5-6-8-16/h2-4,9-10,16H,5-8,11-15H2,1H3,(H,21,26)
InChIKeyXJTRPDHWSUGUCT-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.06
Rot. Bonds2

About N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide

N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide (PubChem CID 131649936) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide
PubChem CID131649936
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC NameN-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide
SMILESCN1CC(=O)N(c2ccccc2)CC12CCN(C(=O)NC1CCCC1)C2
InChIInChI=1S/C20H28N4O2/c1-22-13-18(25)24(17-9-3-2-4-10-17)15-20(22)11-12-23(14-20)19(26)21-16-7-5-6-8-16/h2-4,9-10,16H,5-8,11-15H2,1H3,(H,21,26)
InChIKeyXJTRPDHWSUGUCT-UHFFFAOYSA-N
XLogP2.06
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzoyl-6-methyl-9-phenyl-2,6,9-triazaspiro[4.5]decan-8-one
CID 131638275
2-(1-fluorocyclobutanecarbonyl)-6-methyl-9-phenyl-2,6,9-triazaspiro[4.5]decan-8-one
CID 131696189
N-(4-ethylphenyl)-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide
CID 131655098
6-methyl-9-phenyl-2-(pyrazolidine-3-carbonyl)-2,6,9-triazaspiro[4.5]decan-8-one
CID 134073025
6-methyl-9-phenyl-2-(pyridine-2-carbonyl)-2,6,9-triazaspiro[4.5]decan-8-one;2,2,2-trifluoroacetic acid
CID 171696056
2-(furan-2-carbonyl)-6-methyl-9-phenyl-2,6,9-triazaspiro[4.5]decan-8-one;2,2,2-trifluoroacetic acid
CID 155862799
N-(2-fluorophenyl)-6-methyl-8-oxo-9-thiophen-3-yl-2,6,9-triazaspiro[4.5]decane-2-carboxamide
CID 131650297
6-methyl-8-oxo-N-propan-2-yl-9-thiophen-3-yl-2,6,9-triazaspiro[4.5]decane-2-carboxamide;2,2,2-trifluoroacetic acid
CID 118745525
2-(2,2-dimethylpropanoyl)-6-methyl-9-pyridin-3-yl-2,6,9-triazaspiro[4.5]decan-8-one
CID 155875816
N-cyclopentyl-10-(cyclopropylmethyl)-1-methyl-9-oxo-1,4,10-triazaspiro[5.6]dodecane-4-carboxamide
CID 70725318
3,3-difluoro-N-(5-oxo-1-phenylpyrrolidin-3-yl)pyrrolidine-1-carboxamide
CID 146126205
(5R)-9-(3-fluorophenyl)-6-methyl-2-(naphthalene-2-carbonyl)-2,6,9-triazaspiro[4.5]decan-8-one
CID 97373560

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide?
The IUPAC name of N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide (CID 131649936) is N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide?
The canonical SMILES for N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide is CN1CC(=O)N(c2ccccc2)CC12CCN(C(=O)NC1CCCC1)C2.
What is the InChIKey of N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide?
The InChIKey is XJTRPDHWSUGUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c1-22-13-18(25)24(17-9-3-2-4-10-17)15-20(22)11-12-23(14-20)19(26)21-16-7-5-6-8-16/h2-4,9-10,16H,5-8,11-15H2,1H3,(H,21,26).
What are the key properties of N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide?
N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide has a molecular weight of 356.47 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-methyl-8-oxo-9-phenyl-2,6,9-triazaspiro[4.5]decane-2-carboxamide is sourced from PubChem (CID 131649936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).