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

C9H14N4O2 — CID 136957644

IUPACN-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide
SMILESCCNC(=O)CN(C)c1cc(=O)[nH]cn1
InChIInChI=1S/C9H14N4O2/c1-3-10-9(15)5-13(2)7-4-8(14)12-6-11-7/h4,6H,3,5H2,1-2H3,(H,10,15)(H,11,12,14)
InChIKeyHDTICTNCUWSVTJ-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.66
Rot. Bonds4

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

N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide (PubChem CID 136957644) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide
PubChem CID136957644
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC NameN-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide
SMILESCCNC(=O)CN(C)c1cc(=O)[nH]cn1
InChIInChI=1S/C9H14N4O2/c1-3-10-9(15)5-13(2)7-4-8(14)12-6-11-7/h4,6H,3,5H2,1-2H3,(H,10,15)(H,11,12,14)
InChIKeyHDTICTNCUWSVTJ-UHFFFAOYSA-N
XLogP-0.66
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Pepteridine B
CID 146684613
Pyrimidine, 4,5-bisethylamino-6-hydroxy-
CID 135814991
Pyrimidine, 5-diethylamino-4-ethylamino-6-hydroxy-
CID 171384170
6-piperazin-1-yl-3H-pyrimidin-4-one
CID 136102540
4-[2-aminoethyl(2,2-difluoroethyl)amino]-1H-pyrimidin-6-one
CID 136728230
4-[2-aminoethyl(2,2,2-trifluoroethyl)amino]-1H-pyrimidin-6-one
CID 136728238
N-(2-(4-methyl-6-oxopyrimidin-1(6H)-yl)ethyl)-2-oxo-2,3-dihydro-1H-imidazole-4-carboxamide
CID 71795139
3-Methyl-6-piperazin-1-ylpyrimidin-4-one
CID 117713852
6-(4-Methylpiperazin-1-yl)-3,4-dihydropyrimidin-4-one
CID 136102577
4-[ethyl(methyl)amino]-1H-pyrimidin-6-one
CID 136504671
4-[2-aminoethyl(methyl)amino]-1H-pyrimidin-6-one
CID 136977875
N-(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)-N'-methylmethanimidamide
CID 141992089

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide (CID 136957644) is N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide is CCNC(=O)CN(C)c1cc(=O)[nH]cn1.
What is the InChIKey of N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
The InChIKey is HDTICTNCUWSVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-3-10-9(15)5-13(2)7-4-8(14)12-6-11-7/h4,6H,3,5H2,1-2H3,(H,10,15)(H,11,12,14).
What are the key properties of N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide?
N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide has a molecular weight of 210.24 g/mol, XLogP of -0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 136957644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).