(2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide

C7H9FN4O — CID 68982070

IUPAC(2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide
SMILESC[C@](N)(C(N)=O)c1ccnc(F)n1
InChIInChI=1S/C7H9FN4O/c1-7(10,5(9)13)4-2-3-11-6(8)12-4/h2-3H,10H2,1H3,(H2,9,13)/t7-/m1/s1
InChIKeyVZEFQBGZKDTSKQ-SSDOTTSWSA-N
MW184.17 g/mol
LogP-0.73
Rot. Bonds2

About (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide

(2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide (PubChem CID 68982070) has the molecular formula C7H9FN4O and a molecular weight of 184.17 g/mol. Its IUPAC name is (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide
PubChem CID68982070
Molecular FormulaC7H9FN4O
Molecular Weight184.17 g/mol
Exact Mass184.08
IUPAC Name(2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide
SMILESC[C@](N)(C(N)=O)c1ccnc(F)n1
InChIInChI=1S/C7H9FN4O/c1-7(10,5(9)13)4-2-3-11-6(8)12-4/h2-3H,10H2,1H3,(H2,9,13)/t7-/m1/s1
InChIKeyVZEFQBGZKDTSKQ-SSDOTTSWSA-N
XLogP-0.73
TPSA94.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.17
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide?
The IUPAC name of (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide (CID 68982070) is (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide.
What is the SMILES notation for (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide?
The canonical SMILES for (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide is C[C@](N)(C(N)=O)c1ccnc(F)n1.
What is the InChIKey of (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide?
The InChIKey is VZEFQBGZKDTSKQ-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H9FN4O/c1-7(10,5(9)13)4-2-3-11-6(8)12-4/h2-3H,10H2,1H3,(H2,9,13)/t7-/m1/s1.
What are the key properties of (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide?
(2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide has a molecular weight of 184.17 g/mol, XLogP of -0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(2-fluoropyrimidin-4-yl)propanamide is sourced from PubChem (CID 68982070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).