2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide

C11H18N4O2 — CID 136957617

IUPAC2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
SMILESCc1nc(N(CC(N)=O)CC(C)C)cc(=O)[nH]1
InChIInChI=1S/C11H18N4O2/c1-7(2)5-15(6-9(12)16)10-4-11(17)14-8(3)13-10/h4,7H,5-6H2,1-3H3,(H2,12,16)(H,13,14,17)
InChIKeyMVHUWWMYGMFIHC-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.03
Rot. Bonds5

About 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide

2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide (PubChem CID 136957617) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide.

Molecular Properties

Compound Name2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
PubChem CID136957617
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide
SMILESCc1nc(N(CC(N)=O)CC(C)C)cc(=O)[nH]1
InChIInChI=1S/C11H18N4O2/c1-7(2)5-15(6-9(12)16)10-4-11(17)14-8(3)13-10/h4,7H,5-6H2,1-3H3,(H2,12,16)(H,13,14,17)
InChIKeyMVHUWWMYGMFIHC-UHFFFAOYSA-N
XLogP0.03
TPSA92.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
The IUPAC name of 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide (CID 136957617) is 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide.
What is the SMILES notation for 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
The canonical SMILES for 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide is Cc1nc(N(CC(N)=O)CC(C)C)cc(=O)[nH]1.
What is the InChIKey of 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
The InChIKey is MVHUWWMYGMFIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-7(2)5-15(6-9(12)16)10-4-11(17)14-8(3)13-10/h4,7H,5-6H2,1-3H3,(H2,12,16)(H,13,14,17).
What are the key properties of 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide?
2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide has a molecular weight of 238.29 g/mol, XLogP of 0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyl-6-oxo-1H-pyrimidin-4-yl)-(2-methylpropyl)amino]acetamide is sourced from PubChem (CID 136957617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).