N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide

C7H15FN2O — CID 130562063

IUPACN-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide
SMILESC[C@H](CN)NC(=O)C(C)(C)F
InChIInChI=1S/C7H15FN2O/c1-5(4-9)10-6(11)7(2,3)8/h5H,4,9H2,1-3H3,(H,10,11)/t5-/m1/s1
InChIKeyOQYPYPFLEDGZGC-RXMQYKEDSA-N
MW162.21 g/mol
LogP0.20
Rot. Bonds3

About N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide

N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide (PubChem CID 130562063) has the molecular formula C7H15FN2O and a molecular weight of 162.21 g/mol. Its IUPAC name is N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide.

Molecular Properties

Compound NameN-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide
PubChem CID130562063
Molecular FormulaC7H15FN2O
Molecular Weight162.21 g/mol
Exact Mass162.12
IUPAC NameN-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide
SMILESC[C@H](CN)NC(=O)C(C)(C)F
InChIInChI=1S/C7H15FN2O/c1-5(4-9)10-6(11)7(2,3)8/h5H,4,9H2,1-3H3,(H,10,11)/t5-/m1/s1
InChIKeyOQYPYPFLEDGZGC-RXMQYKEDSA-N
XLogP0.20
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.21
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide?
The IUPAC name of N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide (CID 130562063) is N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide.
What is the SMILES notation for N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide?
The canonical SMILES for N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide is C[C@H](CN)NC(=O)C(C)(C)F.
What is the InChIKey of N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide?
The InChIKey is OQYPYPFLEDGZGC-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H15FN2O/c1-5(4-9)10-6(11)7(2,3)8/h5H,4,9H2,1-3H3,(H,10,11)/t5-/m1/s1.
What are the key properties of N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide?
N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide has a molecular weight of 162.21 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-aminopropan-2-yl]-2-fluoro-2-methylpropanamide is sourced from PubChem (CID 130562063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).