N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide

C10H16N2O3 — CID 63251606

IUPACN-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide
SMILESNC1CCCC1NC(=O)C1=COCCO1
InChIInChI=1S/C10H16N2O3/c11-7-2-1-3-8(7)12-10(13)9-6-14-4-5-15-9/h6-8H,1-5,11H2,(H,12,13)
InChIKeyVQIBFPVTXCKJDR-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.13
Rot. Bonds2

About N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide

N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide (PubChem CID 63251606) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide.

Molecular Properties

Compound NameN-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide
PubChem CID63251606
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC NameN-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide
SMILESNC1CCCC1NC(=O)C1=COCCO1
InChIInChI=1S/C10H16N2O3/c11-7-2-1-3-8(7)12-10(13)9-6-14-4-5-15-9/h6-8H,1-5,11H2,(H,12,13)
InChIKeyVQIBFPVTXCKJDR-UHFFFAOYSA-N
XLogP-0.13
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminocyclopentyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 63251687
N-[(1S,2R)-2-aminocyclohexyl]benzamide
CID 15151854
N-[(1S,2S)-2-aminocyclohexyl]benzamide
CID 15151853
N-(2-aminocyclopentyl)-1,5-dimethylpyrrole-2-carboxamide
CID 63251565
N-(2-aminocyclopentyl)-2-chlorobenzamide
CID 63251263
N-(2-aminocyclohexyl)-5-methylfuran-3-carboxamide
CID 114821924
N-(2-aminocyclopentyl)-2,4-dihydroxybenzamide
CID 63251225
N-(4-bromo-2,6-dimethylphenyl)-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 60793250
N-[(1S,2S)-2-aminocyclopentyl]-2,6-dimethoxybenzamide
CID 118308160
N-[(1R,2S)-2-aminocyclopentyl]-2,6-dimethoxybenzamide
CID 122452181
N-(2-aminocycloheptyl)furan-3-carboxamide
CID 63258203
N-[(1R,2R)-2-aminocyclohexyl]-5-bromofuran-2-carboxamide
CID 93452199

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
The IUPAC name of N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide (CID 63251606) is N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide.
What is the SMILES notation for N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
The canonical SMILES for N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide is NC1CCCC1NC(=O)C1=COCCO1.
What is the InChIKey of N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
The InChIKey is VQIBFPVTXCKJDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c11-7-2-1-3-8(7)12-10(13)9-6-14-4-5-15-9/h6-8H,1-5,11H2,(H,12,13).
What are the key properties of N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide?
N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide has a molecular weight of 212.25 g/mol, XLogP of -0.13, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentyl)-2,3-dihydro-1,4-dioxine-5-carboxamide is sourced from PubChem (CID 63251606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).