2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide

C12H20N4O — CID 119305616

IUPAC2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide
SMILESCC(C)(N)C(=O)Nc1cnc(C(C)(C)C)nc1
InChIInChI=1S/C12H20N4O/c1-11(2,3)9-14-6-8(7-15-9)16-10(17)12(4,5)13/h6-7H,13H2,1-5H3,(H,16,17)
InChIKeyZEFSYJQSESUBIL-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.45
Rot. Bonds2

About 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide

2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide (PubChem CID 119305616) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide
PubChem CID119305616
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide
SMILESCC(C)(N)C(=O)Nc1cnc(C(C)(C)C)nc1
InChIInChI=1S/C12H20N4O/c1-11(2,3)9-14-6-8(7-15-9)16-10(17)12(4,5)13/h6-7H,13H2,1-5H3,(H,16,17)
InChIKeyZEFSYJQSESUBIL-UHFFFAOYSA-N
XLogP1.45
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-(2-tert-butylpyrimidin-5-yl)cyclopropane-1-carboxamide
CID 119752735
2-amino-N-(6-methoxy-3-pyridinyl)-2-methylpropanamide
CID 61266355
4-amino-N-(2-tert-butylpyrimidin-5-yl)pentanamide
CID 120561407
N-(2-tert-butylpyrimidin-5-yl)-5-methylthiophene-2-carboxamide
CID 47416565
3-amino-N-(2-tert-butylpyrimidin-5-yl)cyclopentane-1-carboxamide
CID 119752747
2-amino-2-methyl-N-phenylpropanamide;hydrochloride
CID 53409029
1-(2-tert-butylpyrimidin-5-yl)-3-(2-ethyl-2-hydroxybutyl)urea
CID 111103718
N-(2-tert-butylpyrimidin-5-yl)-4-methoxybutanamide
CID 47416531
3-(2-tert-butylpyrimidin-5-yl)-1-cyclobutyl-1-methylurea
CID 97218500
1-(2-tert-butylpyrimidin-5-yl)-3-[3-(hydroxymethyl)pentan-3-yl]urea
CID 111926186
2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide
CID 119307130
N-(2-tert-butylpyrimidin-5-yl)-4-ethylthiadiazole-5-carboxamide
CID 47418901

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide?
The IUPAC name of 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide (CID 119305616) is 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide?
The canonical SMILES for 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide is CC(C)(N)C(=O)Nc1cnc(C(C)(C)C)nc1.
What is the InChIKey of 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide?
The InChIKey is ZEFSYJQSESUBIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-11(2,3)9-14-6-8(7-15-9)16-10(17)12(4,5)13/h6-7H,13H2,1-5H3,(H,16,17).
What are the key properties of 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide?
2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide has a molecular weight of 236.32 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-tert-butylpyrimidin-5-yl)-2-methylpropanamide is sourced from PubChem (CID 119305616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).