5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one

C8H14N4O — CID 83851911

IUPAC5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one
SMILESCN(C)c1ncc(CCN)c(=O)[nH]1
InChIInChI=1S/C8H14N4O/c1-12(2)8-10-5-6(3-4-9)7(13)11-8/h5H,3-4,9H2,1-2H3,(H,10,11,13)
InChIKeyMWSUIVWHURKXDL-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.66
Rot. Bonds3

About 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one

5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one (PubChem CID 83851911) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one
PubChem CID83851911
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one
SMILESCN(C)c1ncc(CCN)c(=O)[nH]1
InChIInChI=1S/C8H14N4O/c1-12(2)8-10-5-6(3-4-9)7(13)11-8/h5H,3-4,9H2,1-2H3,(H,10,11,13)
InChIKeyMWSUIVWHURKXDL-UHFFFAOYSA-N
XLogP-0.66
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(Diethylamino)-5-methylpyrimidin-4-ol
CID 602372
2-[(Dimethylamino)methyleneamino]-5-methylpyrimidin-4-one
CID 100976562
4(1H)-Pyrimidinone, 2-amino-5-ethyl-
CID 147274
2-Diethylamino-5-(2,2,2-trifluoro-ethyl)-pyrimidin-4-OL
CID 58845186
3-ethyl-6-fluoro-7-methyl-9H-pyrimido[1,2-a]pyrimidine-2,8-dione
CID 118005247
5-Methylaminoethyl-2-selenouracil
CID 129858036
N,N-dimethyl-N'-(5-methyl-6-oxo-1H-pyrimidin-2-yl)methanimidamide
CID 15451604
5-methyl-2-(methylamino)-1H-pyrimidin-6-one
CID 21304629
5-butyl-2-(ethylamino)-1H-pyrimidin-6-one
CID 21488451
2-(dimethylamino)-5-ethyl-1H-pyrimidin-6-one
CID 21488452
2-(dimethylamino)-5-methyl-1H-pyrimidin-6-one
CID 54040575
2-(diethylamino)-5-ethyl-1H-pyrimidin-6-one
CID 58091021

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one?
The IUPAC name of 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one (CID 83851911) is 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one.
What is the SMILES notation for 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one?
The canonical SMILES for 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one is CN(C)c1ncc(CCN)c(=O)[nH]1.
What is the InChIKey of 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one?
The InChIKey is MWSUIVWHURKXDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-12(2)8-10-5-6(3-4-9)7(13)11-8/h5H,3-4,9H2,1-2H3,(H,10,11,13).
What are the key properties of 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one?
5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one has a molecular weight of 182.23 g/mol, XLogP of -0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminoethyl)-2-(dimethylamino)-1H-pyrimidin-6-one is sourced from PubChem (CID 83851911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).