3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide

C15H18N4O — CID 62878158

IUPAC3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide
SMILESCc1cc(C)nc(NC(=O)C(CN)c2ccccc2)n1
InChIInChI=1S/C15H18N4O/c1-10-8-11(2)18-15(17-10)19-14(20)13(9-16)12-6-4-3-5-7-12/h3-8,13H,9,16H2,1-2H3,(H,17,18,19,20)
InChIKeyGMOZPBXVFRUNIL-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.77
Rot. Bonds4

About 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide

3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide (PubChem CID 62878158) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide
PubChem CID62878158
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide
SMILESCc1cc(C)nc(NC(=O)C(CN)c2ccccc2)n1
InChIInChI=1S/C15H18N4O/c1-10-8-11(2)18-15(17-10)19-14(20)13(9-16)12-6-4-3-5-7-12/h3-8,13H,9,16H2,1-2H3,(H,17,18,19,20)
InChIKeyGMOZPBXVFRUNIL-UHFFFAOYSA-N
XLogP1.77
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(4,6-dimethylpyrimidin-2-yl)amino]-2-phenylpropanoic acid
CID 62876566
3-amino-N-(2-ethylphenyl)-2-phenylpropanamide
CID 62878156
(2R)-N-(4,6-dimethylpyrimidin-2-yl)-2-phenyl-2-phenylsulfanylacetamide
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3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-phenylpropanamide
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2-[2-(aminomethyl)phenyl]-N-(4,6-dimethylpyrimidin-2-yl)acetamide
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3-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-phenylpropanamide;hydrochloride
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3-amino-2-phenyl-N-thieno[2,3-c]pyridin-2-ylpropanamide
CID 175026342
N-(4-acetylphenyl)-3-amino-2-phenylpropanamide
CID 62877329
3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide
CID 104618025
3-amino-N-(3,5-dichloro-4-fluorophenyl)-2-phenylpropanamide
CID 107574522
3-amino-N-(4-aminothiophen-3-yl)-2-phenylpropanamide
CID 174481948
ditert-butyl 5-[(3-amino-2-phenylpropanoyl)amino]benzene-1,3-dicarboxylate
CID 70283606

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide?
The IUPAC name of 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide (CID 62878158) is 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide is Cc1cc(C)nc(NC(=O)C(CN)c2ccccc2)n1.
What is the InChIKey of 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide?
The InChIKey is GMOZPBXVFRUNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-10-8-11(2)18-15(17-10)19-14(20)13(9-16)12-6-4-3-5-7-12/h3-8,13H,9,16H2,1-2H3,(H,17,18,19,20).
What are the key properties of 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide?
3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide has a molecular weight of 270.34 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide is sourced from PubChem (CID 62878158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).