3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide

C9H18N2O2 — CID 106114319

IUPAC3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide
SMILESCCC1CC1NC(=O)C(CN)OC
InChIInChI=1S/C9H18N2O2/c1-3-6-4-7(6)11-9(12)8(5-10)13-2/h6-8H,3-5,10H2,1-2H3,(H,11,12)
InChIKeyYEYFFUUBICRMHI-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.13
Rot. Bonds5

About 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide

3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide (PubChem CID 106114319) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide.

Molecular Properties

Compound Name3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide
PubChem CID106114319
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide
SMILESCCC1CC1NC(=O)C(CN)OC
InChIInChI=1S/C9H18N2O2/c1-3-6-4-7(6)11-9(12)8(5-10)13-2/h6-8H,3-5,10H2,1-2H3,(H,11,12)
InChIKeyYEYFFUUBICRMHI-UHFFFAOYSA-N
XLogP-0.13
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide?
The IUPAC name of 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide (CID 106114319) is 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide.
What is the SMILES notation for 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide?
The canonical SMILES for 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide is CCC1CC1NC(=O)C(CN)OC.
What is the InChIKey of 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide?
The InChIKey is YEYFFUUBICRMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-3-6-4-7(6)11-9(12)8(5-10)13-2/h6-8H,3-5,10H2,1-2H3,(H,11,12).
What are the key properties of 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide?
3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide has a molecular weight of 186.25 g/mol, XLogP of -0.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethylcyclopropyl)-2-methoxypropanamide is sourced from PubChem (CID 106114319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).