N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide

C7H11NO2 — CID 89246188

IUPACN-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide
SMILESCON(C)C(=O)C1(C)C=C1
InChIInChI=1S/C7H11NO2/c1-7(4-5-7)6(9)8(2)10-3/h4-5H,1-3H3
InChIKeyGPGHMAVGRHUEGS-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.58
Rot. Bonds2

About N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide

N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide (PubChem CID 89246188) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide.

Molecular Properties

Compound NameN-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide
PubChem CID89246188
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC NameN-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide
SMILESCON(C)C(=O)C1(C)C=C1
InChIInChI=1S/C7H11NO2/c1-7(4-5-7)6(9)8(2)10-3/h4-5H,1-3H3
InChIKeyGPGHMAVGRHUEGS-UHFFFAOYSA-N
XLogP0.58
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide?
The IUPAC name of N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide (CID 89246188) is N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide.
What is the SMILES notation for N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide?
The canonical SMILES for N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide is CON(C)C(=O)C1(C)C=C1.
What is the InChIKey of N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide?
The InChIKey is GPGHMAVGRHUEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2/c1-7(4-5-7)6(9)8(2)10-3/h4-5H,1-3H3.
What are the key properties of N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide?
N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide has a molecular weight of 141.17 g/mol, XLogP of 0.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N,1-dimethylcycloprop-2-ene-1-carboxamide is sourced from PubChem (CID 89246188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).