N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide

C14H22N4O2 — CID 46985205

IUPACN-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
SMILESCC1=NC2(CCN(C(=O)NC3CCCC3)CC2)C(=O)N1
InChIInChI=1S/C14H22N4O2/c1-10-15-12(19)14(17-10)6-8-18(9-7-14)13(20)16-11-4-2-3-5-11/h11H,2-9H2,1H3,(H,16,20)(H,15,17,19)
InChIKeyIGIRPUSGUHWYLW-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.02
Rot. Bonds1

About N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide

N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide (PubChem CID 46985205) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
PubChem CID46985205
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
SMILESCC1=NC2(CCN(C(=O)NC3CCCC3)CC2)C(=O)N1
InChIInChI=1S/C14H22N4O2/c1-10-15-12(19)14(17-10)6-8-18(9-7-14)13(20)16-11-4-2-3-5-11/h11H,2-9H2,1H3,(H,16,20)(H,15,17,19)
InChIKeyIGIRPUSGUHWYLW-UHFFFAOYSA-N
XLogP1.02
TPSA73.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-Methylbutyl)-8-[(4-methylpiperazin-1-yl)carbonyl]-1,3,8-triazaspiro[4.5]dec-1-en-4-one
CID 46999670
2-cyclopropyl-N-ethyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
CID 46985220
N-{1-[(2-butyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-en-8-yl)carbonyl]-2-methylpropyl}acetamide
CID 46982582
N-ethyl-2-(methoxymethyl)-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
CID 50953560
4-[[2-amino-4-methyl-4-(2-methylpropyl)-5-oxoimidazol-1-yl]methyl]-N-cyclopentylpiperidine-1-carboxamide
CID 57844823
1-((4-Oxo-1,3,8-triazaspiro[4.5]dec-1-en-2-yl)methyl)pyrrolidine-2,5-dione
CID 57908092
N-((4-oxo-1,3,8-triazaspiro[4.5]dec-1-en-2-yl)methyl)acetamide
CID 57908095
2-Methyl-8-propan-2-yl-1,3,8-triazaspiro[4.5]dec-1-en-4-one
CID 70995660
2-(1-Acetylpiperidin-4-yl)-1,3,8-triazaspiro[4.5]dec-1-en-4-one
CID 117745840
2-Propyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one
CID 117745860
2-(1-Acetylpiperidin-4-yl)-3-methyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one
CID 118480267
2,8-Dimethyl-1,3,8-triazaspiro[4.5]dec-1-en-4-one;ethane
CID 145391092

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide?
The IUPAC name of N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide (CID 46985205) is N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide?
The canonical SMILES for N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide is CC1=NC2(CCN(C(=O)NC3CCCC3)CC2)C(=O)N1.
What is the InChIKey of N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide?
The InChIKey is IGIRPUSGUHWYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-10-15-12(19)14(17-10)6-8-18(9-7-14)13(20)16-11-4-2-3-5-11/h11H,2-9H2,1H3,(H,16,20)(H,15,17,19).
What are the key properties of N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide?
N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-4-oxo-1,3,8-triazaspiro[4.5]dec-1-ene-8-carboxamide is sourced from PubChem (CID 46985205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).