3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide

C10H17NO2 — CID 89102890

IUPAC3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide
SMILESC=CCOC(CC1CC1)C(=O)NC
InChIInChI=1S/C10H17NO2/c1-3-6-13-9(10(12)11-2)7-8-4-5-8/h3,8-9H,1,4-7H2,2H3,(H,11,12)
InChIKeyCMXSCSOXAAGYMU-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.10
Rot. Bonds6

About 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide

3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide (PubChem CID 89102890) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide.

Molecular Properties

Compound Name3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide
PubChem CID89102890
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide
SMILESC=CCOC(CC1CC1)C(=O)NC
InChIInChI=1S/C10H17NO2/c1-3-6-13-9(10(12)11-2)7-8-4-5-8/h3,8-9H,1,4-7H2,2H3,(H,11,12)
InChIKeyCMXSCSOXAAGYMU-UHFFFAOYSA-N
XLogP1.10
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide?
The IUPAC name of 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide (CID 89102890) is 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide.
What is the SMILES notation for 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide?
The canonical SMILES for 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide is C=CCOC(CC1CC1)C(=O)NC.
What is the InChIKey of 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide?
The InChIKey is CMXSCSOXAAGYMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-3-6-13-9(10(12)11-2)7-8-4-5-8/h3,8-9H,1,4-7H2,2H3,(H,11,12).
What are the key properties of 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide?
3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide has a molecular weight of 183.25 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-methyl-2-prop-2-enoxypropanamide is sourced from PubChem (CID 89102890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).