2-phenyl-2-pyrimidin-5-ylpropanamide

C13H13N3O — CID 129285738

IUPAC2-phenyl-2-pyrimidin-5-ylpropanamide
SMILESCC(C(N)=O)(c1ccccc1)c1cncnc1
InChIInChI=1S/C13H13N3O/c1-13(12(14)17,10-5-3-2-4-6-10)11-7-15-9-16-8-11/h2-9H,1H3,(H2,14,17)
InChIKeyRIMZFONURFPBGT-UHFFFAOYSA-N
MW227.27 g/mol
LogP1.27
Rot. Bonds3

About 2-phenyl-2-pyrimidin-5-ylpropanamide

2-phenyl-2-pyrimidin-5-ylpropanamide (PubChem CID 129285738) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is 2-phenyl-2-pyrimidin-5-ylpropanamide.

Molecular Properties

Compound Name2-phenyl-2-pyrimidin-5-ylpropanamide
PubChem CID129285738
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name2-phenyl-2-pyrimidin-5-ylpropanamide
SMILESCC(C(N)=O)(c1ccccc1)c1cncnc1
InChIInChI=1S/C13H13N3O/c1-13(12(14)17,10-5-3-2-4-6-10)11-7-15-9-16-8-11/h2-9H,1H3,(H2,14,17)
InChIKeyRIMZFONURFPBGT-UHFFFAOYSA-N
XLogP1.27
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-2-(1,3-thiazol-2-yl)propanamide
CID 67042074
2-(benzylamino)-2-pyridin-3-ylpropanamide
CID 54891500
(2S)-2-amino-2-pyridin-3-ylpropanoic acid;hydrochloride
CID 71485674
2,2-diphenylpentan-3-one
CID 70793023
1,1-diphenylethyl carbamate
CID 20976713
1-(3-chlorophenyl)-1-pyrimidin-5-ylethanamine
CID 62490873
2-methyl-2-phenylpropanethioamide
CID 59837413
2-amino-2-hydroxy-2-phenylacetamide
CID 149436781
2,2-diphenyl-2-pyrimidin-5-ylacetonitrile
CID 18994305
2-(1,1-diphenylethyl)propanediamide
CID 175584560
2-methyl-2,3-dipyridin-3-ylpropanamide
CID 126521442
N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide
CID 139000795

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-pyrimidin-5-ylpropanamide?
The IUPAC name of 2-phenyl-2-pyrimidin-5-ylpropanamide (CID 129285738) is 2-phenyl-2-pyrimidin-5-ylpropanamide.
What is the SMILES notation for 2-phenyl-2-pyrimidin-5-ylpropanamide?
The canonical SMILES for 2-phenyl-2-pyrimidin-5-ylpropanamide is CC(C(N)=O)(c1ccccc1)c1cncnc1.
What is the InChIKey of 2-phenyl-2-pyrimidin-5-ylpropanamide?
The InChIKey is RIMZFONURFPBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-13(12(14)17,10-5-3-2-4-6-10)11-7-15-9-16-8-11/h2-9H,1H3,(H2,14,17).
What are the key properties of 2-phenyl-2-pyrimidin-5-ylpropanamide?
2-phenyl-2-pyrimidin-5-ylpropanamide has a molecular weight of 227.27 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-pyrimidin-5-ylpropanamide is sourced from PubChem (CID 129285738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).