trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide

C9H15NO2 — CID 11298196

IUPACtrans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide
SMILESC=C[C@@]1(C)C[C@H]1C(=O)N(C)OC
InChIInChI=1S/C9H15NO2/c1-5-9(2)6-7(9)8(11)10(3)12-4/h5,7H,1,6H2,2-4H3/t7-,9-/m0/s1
InChIKeyZUZLJJXQTTZRFQ-CBAPKCEASA-N
MW169.22 g/mol
LogP1.22
Rot. Bonds3

About trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide

trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide (PubChem CID 11298196) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide.

Molecular Properties

Compound Nametrans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide
PubChem CID11298196
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Nametrans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide
SMILESC=C[C@@]1(C)C[C@H]1C(=O)N(C)OC
InChIInChI=1S/C9H15NO2/c1-5-9(2)6-7(9)8(11)10(3)12-4/h5,7H,1,6H2,2-4H3/t7-,9-/m0/s1
InChIKeyZUZLJJXQTTZRFQ-CBAPKCEASA-N
XLogP1.22
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.22
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'}

Analyze trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

trans-methyl (1S,2S)-2-ethenyl-2-methylcyclopropane-1-carboxylate
CID 10909650
trans-(1S,2R)-2-(hydroxymethyl)-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide
CID 6712533
N-methoxy-N-methylspiro[2.3]hexane-2-carboxamide
CID 130725563
1-ethyl-2-[methoxy(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 122670168
4-amino-N-methoxy-N,2,2,3-tetramethylcyclohexane-1-carboxamide
CID 102628653
2-fluoro-N-methoxy-N-methyl-2-phenylcyclopropane-1-carboxamide
CID 123258315
N-methoxy-N-methyl-2-oxaspiro[3.3]heptane-6-carboxamide
CID 126844449
3,3-difluoro-N-methoxy-N,2-dimethylcyclobutane-1-carboxamide
CID 178088138
N-methoxy-N-methylcyclobutanecarboxamide
CID 45084194
3,3-difluoro-N-methoxy-N-methylpiperidine-4-carboxamide
CID 130719412
(4S,5R)-5-[(1S)-1-hydroxyprop-2-enyl]-N-methoxy-N,2,2-trimethyl-1,3-dioxolane-4-carboxamide
CID 164675424
benzene;N-methoxy-N-methylcyclopropanecarboxamide
CID 170770192

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide?
The IUPAC name of trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide (CID 11298196) is trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide.
What is the SMILES notation for trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide?
The canonical SMILES for trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide is C=C[C@@]1(C)C[C@H]1C(=O)N(C)OC.
What is the InChIKey of trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide?
The InChIKey is ZUZLJJXQTTZRFQ-CBAPKCEASA-N. The full InChI is InChI=1S/C9H15NO2/c1-5-9(2)6-7(9)8(11)10(3)12-4/h5,7H,1,6H2,2-4H3/t7-,9-/m0/s1.
What are the key properties of trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide?
trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide has a molecular weight of 169.22 g/mol, XLogP of 1.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-ethenyl-N-methoxy-N,2-dimethylcyclopropane-1-carboxamide is sourced from PubChem (CID 11298196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).