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

C12H20N4O2 — CID 136870167

IUPACN-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide
SMILESCCN(C)C(=O)CNc1cc(=O)[nH]c(C(C)C)n1
InChIInChI=1S/C12H20N4O2/c1-5-16(4)11(18)7-13-9-6-10(17)15-12(14-9)8(2)3/h6,8H,5,7H2,1-4H3,(H2,13,14,15,17)
InChIKeyOWYULRYBCDWRQP-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.78
Rot. Bonds5

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

N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide (PubChem CID 136870167) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide
PubChem CID136870167
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC NameN-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide
SMILESCCN(C)C(=O)CNc1cc(=O)[nH]c(C(C)C)n1
InChIInChI=1S/C12H20N4O2/c1-5-16(4)11(18)7-13-9-6-10(17)15-12(14-9)8(2)3/h6,8H,5,7H2,1-4H3,(H2,13,14,15,17)
InChIKeyOWYULRYBCDWRQP-UHFFFAOYSA-N
XLogP0.78
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-acetamido-2-oxopyrimidin-1-yl)-N,N-diethylacetamide
CID 296597
2-(4-chloro-6-oxo-2-propan-2-ylpyrimidin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 114585012
4-[2-aminoethyl(2,2-difluoroethyl)amino]-2-ethyl-1H-pyrimidin-6-one
CID 136728227
4-[2-aminoethyl(2,2,2-trifluoroethyl)amino]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136728236
4-[2-aminoethyl(2,2-difluoroethyl)amino]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136932127
2-(methylamino)-N-(4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-2-yl)acetamide
CID 164573864
N-(2-methylpropyl)-6-oxo-1H-pyrimidine-2-carboxamide
CID 172999735
4-Amino-6-oxo-1-propylpyrimidine-2-carboxamide
CID 173128226
2-[[4-(2-Methylpropyl)-3-oxopyrazin-2-yl]amino]ethylurea
CID 83092322
1,1-Dimethyl-3-[2-[[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]ethyl]urea
CID 83113404
2-(1-Aminoethyl)-6-(dimethylamino)-3-methylpyrimidin-4-one
CID 84667044
2-(2-Aminoethyl)-6-(dimethylamino)-3-methylpyrimidin-4-one
CID 84667045

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide?
The IUPAC name of N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide (CID 136870167) is N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide is CCN(C)C(=O)CNc1cc(=O)[nH]c(C(C)C)n1.
What is the InChIKey of N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide?
The InChIKey is OWYULRYBCDWRQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-5-16(4)11(18)7-13-9-6-10(17)15-12(14-9)8(2)3/h6,8H,5,7H2,1-4H3,(H2,13,14,15,17).
What are the key properties of N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide?
N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide has a molecular weight of 252.32 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-[(6-oxo-2-propan-2-yl-1H-pyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 136870167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).