N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide

C11H17N3O2 — CID 122301757

IUPACN-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide
SMILESCCOc1ncc(NC(=O)C(C)(C)C)cn1
InChIInChI=1S/C11H17N3O2/c1-5-16-10-12-6-8(7-13-10)14-9(15)11(2,3)4/h6-7H,5H2,1-4H3,(H,14,15)
InChIKeyJTPAMVQIKTZXEV-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.86
Rot. Bonds3

About N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide

N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide (PubChem CID 122301757) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide
PubChem CID122301757
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide
SMILESCCOc1ncc(NC(=O)C(C)(C)C)cn1
InChIInChI=1S/C11H17N3O2/c1-5-16-10-12-6-8(7-13-10)14-9(15)11(2,3)4/h6-7H,5H2,1-4H3,(H,14,15)
InChIKeyJTPAMVQIKTZXEV-UHFFFAOYSA-N
XLogP1.86
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-(2-phenoxypyrimidin-5-yl)propanamide
CID 122302193
N-(2-ethoxypyrimidin-5-yl)cyclopropanecarboxamide
CID 122301831
N-(2-ethoxypyrimidin-5-yl)-4-methylbenzamide
CID 122301767
1-(2-ethoxypyrimidin-5-yl)-3-[4-(trifluoromethoxy)phenyl]urea
CID 122301912
N-(4-ethoxy-3,5-dimethylphenyl)-2,2-dimethylpropanamide
CID 100690476
N-[4-(4-ethoxyphenoxy)phenyl]-2,2-dimethylpropanamide
CID 26242416
2,2-dimethyl-N-[6-(propanoylamino)-3-pyridinyl]propanamide
CID 1452729
N-(2-ethoxypyrimidin-5-yl)-4-phenylbenzamide
CID 122301792
N-(2-ethoxypyrimidin-5-yl)thiophene-2-carboxamide
CID 122301798
N-(2-ethoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide
CID 122301975
N-[6-(butanoylamino)-3-pyridinyl]-2,2-dimethylpropanamide
CID 1452758
1-(2,4-difluorophenyl)-3-(2-ethoxypyrimidin-5-yl)urea
CID 122301865

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide (CID 122301757) is N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide is CCOc1ncc(NC(=O)C(C)(C)C)cn1.
What is the InChIKey of N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide?
The InChIKey is JTPAMVQIKTZXEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-5-16-10-12-6-8(7-13-10)14-9(15)11(2,3)4/h6-7H,5H2,1-4H3,(H,14,15).
What are the key properties of N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide?
N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide has a molecular weight of 223.28 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxypyrimidin-5-yl)-2,2-dimethylpropanamide is sourced from PubChem (CID 122301757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).