2-[1-(difluoromethyl)cyclopropyl]acetamide

C6H9F2NO — CID 175789145

IUPAC2-[1-(difluoromethyl)cyclopropyl]acetamide
SMILESNC(=O)CC1(C(F)F)CC1
InChIInChI=1S/C6H9F2NO/c7-5(8)6(1-2-6)3-4(9)10/h5H,1-3H2,(H2,9,10)
InChIKeyYJNPGEAQXLMTPE-UHFFFAOYSA-N
MW149.14 g/mol
LogP0.91
Rot. Bonds3

About 2-[1-(difluoromethyl)cyclopropyl]acetamide

2-[1-(difluoromethyl)cyclopropyl]acetamide (PubChem CID 175789145) has the molecular formula C6H9F2NO and a molecular weight of 149.14 g/mol. Its IUPAC name is 2-[1-(difluoromethyl)cyclopropyl]acetamide.

Molecular Properties

Compound Name2-[1-(difluoromethyl)cyclopropyl]acetamide
PubChem CID175789145
Molecular FormulaC6H9F2NO
Molecular Weight149.14 g/mol
Exact Mass149.07
IUPAC Name2-[1-(difluoromethyl)cyclopropyl]acetamide
SMILESNC(=O)CC1(C(F)F)CC1
InChIInChI=1S/C6H9F2NO/c7-5(8)6(1-2-6)3-4(9)10/h5H,1-3H2,(H2,9,10)
InChIKeyYJNPGEAQXLMTPE-UHFFFAOYSA-N
XLogP0.91
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.14
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(difluoromethyl)cyclopropyl]acetamide?
The IUPAC name of 2-[1-(difluoromethyl)cyclopropyl]acetamide (CID 175789145) is 2-[1-(difluoromethyl)cyclopropyl]acetamide.
What is the SMILES notation for 2-[1-(difluoromethyl)cyclopropyl]acetamide?
The canonical SMILES for 2-[1-(difluoromethyl)cyclopropyl]acetamide is NC(=O)CC1(C(F)F)CC1.
What is the InChIKey of 2-[1-(difluoromethyl)cyclopropyl]acetamide?
The InChIKey is YJNPGEAQXLMTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F2NO/c7-5(8)6(1-2-6)3-4(9)10/h5H,1-3H2,(H2,9,10).
What are the key properties of 2-[1-(difluoromethyl)cyclopropyl]acetamide?
2-[1-(difluoromethyl)cyclopropyl]acetamide has a molecular weight of 149.14 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(difluoromethyl)cyclopropyl]acetamide is sourced from PubChem (CID 175789145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).