2-(1-ethylcyclopropyl)acetamide

C7H13NO — CID 67691253

IUPAC2-(1-ethylcyclopropyl)acetamide
SMILESCCC1(CC(N)=O)CC1
InChIInChI=1S/C7H13NO/c1-2-7(3-4-7)5-6(8)9/h2-5H2,1H3,(H2,8,9)
InChIKeyIIXDETSAPBCPLM-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.05
Rot. Bonds3

About 2-(1-ethylcyclopropyl)acetamide

2-(1-ethylcyclopropyl)acetamide (PubChem CID 67691253) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2-(1-ethylcyclopropyl)acetamide.

Molecular Properties

Compound Name2-(1-ethylcyclopropyl)acetamide
PubChem CID67691253
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2-(1-ethylcyclopropyl)acetamide
SMILESCCC1(CC(N)=O)CC1
InChIInChI=1S/C7H13NO/c1-2-7(3-4-7)5-6(8)9/h2-5H2,1H3,(H2,8,9)
InChIKeyIIXDETSAPBCPLM-UHFFFAOYSA-N
XLogP1.05
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylcyclopropyl)acetamide?
The IUPAC name of 2-(1-ethylcyclopropyl)acetamide (CID 67691253) is 2-(1-ethylcyclopropyl)acetamide.
What is the SMILES notation for 2-(1-ethylcyclopropyl)acetamide?
The canonical SMILES for 2-(1-ethylcyclopropyl)acetamide is CCC1(CC(N)=O)CC1.
What is the InChIKey of 2-(1-ethylcyclopropyl)acetamide?
The InChIKey is IIXDETSAPBCPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-2-7(3-4-7)5-6(8)9/h2-5H2,1H3,(H2,8,9).
What are the key properties of 2-(1-ethylcyclopropyl)acetamide?
2-(1-ethylcyclopropyl)acetamide has a molecular weight of 127.19 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylcyclopropyl)acetamide is sourced from PubChem (CID 67691253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).