2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide

C9H16F2N2O2 — CID 103821150

IUPAC2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide
SMILESCC(N)(C(=O)NCC(O)C(F)F)C1CC1
InChIInChI=1S/C9H16F2N2O2/c1-9(12,5-2-3-5)8(15)13-4-6(14)7(10)11/h5-7,14H,2-4,12H2,1H3,(H,13,15)
InChIKeyMZCRYDVGGLUYAG-UHFFFAOYSA-N
MW222.23 g/mol
LogP-0.14
Rot. Bonds5

About 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide

2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide (PubChem CID 103821150) has the molecular formula C9H16F2N2O2 and a molecular weight of 222.23 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide
PubChem CID103821150
Molecular FormulaC9H16F2N2O2
Molecular Weight222.23 g/mol
Exact Mass222.12
IUPAC Name2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide
SMILESCC(N)(C(=O)NCC(O)C(F)F)C1CC1
InChIInChI=1S/C9H16F2N2O2/c1-9(12,5-2-3-5)8(15)13-4-6(14)7(10)11/h5-7,14H,2-4,12H2,1H3,(H,13,15)
InChIKeyMZCRYDVGGLUYAG-UHFFFAOYSA-N
XLogP-0.14
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.23
LogP ≤ 5-0.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide (CID 103821150) is 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide is CC(N)(C(=O)NCC(O)C(F)F)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide?
The InChIKey is MZCRYDVGGLUYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2O2/c1-9(12,5-2-3-5)8(15)13-4-6(14)7(10)11/h5-7,14H,2-4,12H2,1H3,(H,13,15).
What are the key properties of 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide?
2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide has a molecular weight of 222.23 g/mol, XLogP of -0.14, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-(3,3-difluoro-2-hydroxypropyl)propanamide is sourced from PubChem (CID 103821150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).