N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide

C8H14N2O3 — CID 103901247

IUPACN-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)NOCC(N)=O
InChIInChI=1S/C8H14N2O3/c1-8(2)3-5(8)7(12)10-13-4-6(9)11/h5H,3-4H2,1-2H3,(H2,9,11)(H,10,12)
InChIKeyWHVWWKYOISPWJG-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.43
Rot. Bonds4

About N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide

N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide (PubChem CID 103901247) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide
PubChem CID103901247
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC NameN-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide
SMILESCC1(C)CC1C(=O)NOCC(N)=O
InChIInChI=1S/C8H14N2O3/c1-8(2)3-5(8)7(12)10-13-4-6(9)11/h5H,3-4H2,1-2H3,(H2,9,11)(H,10,12)
InChIKeyWHVWWKYOISPWJG-UHFFFAOYSA-N
XLogP-0.43
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(2,2-dimethylcyclopropanecarbonyl)amino]oxyacetic acid
CID 107000421
N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclohexane-1-carboxamide
CID 107180286
N-(2-amino-2-oxoethoxy)cycloheptanecarboxamide
CID 112550660
(1S)-N-(2-amino-2-oxoethyl)sulfonyl-2,2-dimethylcyclopropane-1-carboxamide
CID 136580902
2-[(4,4-dimethylcyclohexyl)amino]oxyacetamide
CID 112672857
2-[(2,4,4-trimethylcyclohexyl)amino]oxyacetamide
CID 112673312
N-(2-amino-2-oxoethoxy)thiolane-2-carboxamide
CID 112551031
N'-(2,2-difluorocyclopropanecarbonyl)-2,2-dimethylcyclopropane-1-carbohydrazide
CID 90937535
(2S)-N-(2-amino-2-oxoethoxy)oxolane-2-carboxamide
CID 103901237
(2S)-N-(2-amino-2-oxoethoxy)pyrrolidine-2-carboxamide
CID 103955972
2-(aminomethyl)-N-(2-amino-2-oxoethoxy)cyclohexane-1-carboxamide
CID 112674216
2-(cyclopropylamino)oxyacetamide
CID 103439345

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide (CID 103901247) is N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide is CC1(C)CC1C(=O)NOCC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide?
The InChIKey is WHVWWKYOISPWJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-8(2)3-5(8)7(12)10-13-4-6(9)11/h5H,3-4H2,1-2H3,(H2,9,11)(H,10,12).
What are the key properties of N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide?
N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide has a molecular weight of 186.21 g/mol, XLogP of -0.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethoxy)-2,2-dimethylcyclopropane-1-carboxamide is sourced from PubChem (CID 103901247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).