N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide

C15H16N2O3 — CID 6460881

IUPACN-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide
SMILESCN1C(=O)c2ccc(C(=O)NC3CCCC3)cc2C1=O
InChIInChI=1S/C15H16N2O3/c1-17-14(19)11-7-6-9(8-12(11)15(17)20)13(18)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,18)
InChIKeyFDKSORGFQNLZQS-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.58
Rot. Bonds2

About N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide

N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide (PubChem CID 6460881) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide
PubChem CID6460881
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide
SMILESCN1C(=O)c2ccc(C(=O)NC3CCCC3)cc2C1=O
InChIInChI=1S/C15H16N2O3/c1-17-14(19)11-7-6-9(8-12(11)15(17)20)13(18)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,18)
InChIKeyFDKSORGFQNLZQS-UHFFFAOYSA-N
XLogP1.58
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyl-2-(4-fluorophenyl)-1,3-dioxoisoindole-5-carboxamide
CID 9213923
2-methyl-1,3-dioxo-N-(1-propylsulfonylpiperidin-4-yl)isoindole-5-carboxamide
CID 46456097
N-cyclopentyl-5-methyl-11-oxo-6,7,8,9-tetrahydro-5aH-pyrido[2,1-b]quinazoline-3-carboxamide
CID 87054001
2-cyclohexyl-1,3-dioxo-N-pyrrolidin-3-ylisoindole-5-carboxamide;hydrochloride
CID 119450760
N-cyclohexyl-2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxamide
CID 2452442
2-butyl-N-(4-hydroxycyclohexyl)-1,3-dioxoisoindole-5-carboxamide
CID 78767376
N-cycloheptyl-5-methyl-12-oxo-5a,6,7,8,9,10-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
CID 91891160
2-methyl-N-[5-[(2-methyl-1,3-dioxoisoindole-5-carbonyl)amino]pentyl]-1,3-dioxoisoindole-5-carboxamide
CID 169211222
N-cycloheptyl-1-methyl-2-oxo-3H-indole-5-carboxamide
CID 52986175
N-cyclooctyl-1-methyl-2-oxopyridine-4-carboxamide
CID 103610769
2-methyl-N-[[5-[[(2-methyl-1,3-dioxoisoindole-5-carbonyl)amino]methyl]-3,6-dioxopiperazin-2-yl]methyl]-1,3-dioxoisoindole-5-carboxamide
CID 169211204
N-cyclooctyl-4-methylbenzamide
CID 3995245

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide?
The IUPAC name of N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide (CID 6460881) is N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide?
The canonical SMILES for N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide is CN1C(=O)c2ccc(C(=O)NC3CCCC3)cc2C1=O.
What is the InChIKey of N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide?
The InChIKey is FDKSORGFQNLZQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-17-14(19)11-7-6-9(8-12(11)15(17)20)13(18)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,18).
What are the key properties of N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide?
N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-1,3-dioxoisoindole-5-carboxamide is sourced from PubChem (CID 6460881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).